Vitas-M small molecule compound

6-tert-butyl-2-[(morpholin-4-ylacetyl)amino]-N-(3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK383599
SMILES O=C(Nc1sc2c(c1C(=O)Nc1cccc(c1)[N+](=O)[O-])CCC(C2)C(C)(C)C)CN1CCOCC1

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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 C25H32N4O5S MW 500.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O5S/c1-25(2,3)16-7-8-19-20(13-16)35-24(27-21(30)15-28-9-11-34-12-10-28)22(19)23(31)26-17-5-4-6-18(14-17)29(32)33/h4-6,14,16H,7-13,15H2,1-3H3,(H,26,31)(H,27,30)
InChIKey
HTTAFJSRNXWGID-UHFFFAOYSA-N
Synonyms

6tertbutyl2((2morpholin4ylacetyl)amino)N(3nitrophenyl)4567tetrahydro1benzothiophene3carboxamide
6tertbutyl2((morpholin4ylacetyl)amino)N(3nitrophenyl)4567tetrahydro1benzothiophene3carboxamide
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC(=CC=C3)(N+)(=O)(O))NC(=O)CN4CCOCC4
InChI=1SC25H32N4O5Sc125(23)16781920(1316)3524(2721(30)152891134121028)22(19)23(31)261754618(1417)29(32)33h461416H71315H213H3(H2631)(H2730)
MFCD03648759
O=C(Nc1sc2c(c1C(=O)Nc1cccc(c1)(N+)(=O)(O))CCC(C2)C(C)(C)C)CN1CCOCC1
ZINC000015946698
ZINC000015946700

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Available files

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