Vitas-M small molecule compound

N-[(4-{[4-(propan-2-yl)phenyl]carbamoyl}cyclohexyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Catalog ID
STL058027
SMILES O=C(C1CCC(CC1)CNC(=O)C1NCc2c(C1)cccc2)Nc1ccc(cc1)C(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H35N3O2 MW 433.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N3O2/c1-18(2)20-11-13-24(14-12-20)30-26(31)21-9-7-19(8-10-21)16-29-27(32)25-15-22-5-3-4-6-23(22)17-28-25/h3-6,11-14,18-19,21,25,28H,7-10,15-17H2,1-2H3,(H,29,32)(H,30,31)
InChIKey
LLLHJQXFZNAVMJ-UHFFFAOYSA-N
Synonyms

(S)N(((1r4S)4((4isopropylphenyl)carbamoyl)cyclohexyl)methyl)1234tetrahydroisoquinoline3carboxamidehydrochloride
CC(C)C1=CC=C(C=C1)NC(=O)C2CCC(CC2)CNC(=O)C3CC4=CC=CC=C4CN3
InChI=1SC27H35N3O2c118(2)20111324(141220)3026(31)219719(81021)162927(32)251522534623(22)172825h3611141819212528H7101517H212H3(H2932)(H3031)
MFCD18192886
N((4((4(propan2yl)phenyl)carbamoyl)cyclohexyl)methyl)1234tetrahydroisoquinoline3carboxamide
N((4((4propan2ylphenyl)carbamoyl)cyclohexyl)methyl)1234tetrahydroisoquinoline3carboxamide
O=C((C@@H)1CCC(CC1)CNC(=O)(C@H)1NCc2c(C1)cccc2)Nc1ccc(cc1)C(C)CCl
ZINC000035485526
ZINC000035855931

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Available files

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