Vitas-M small molecule compound
5-amino-1-{2-[(3,4-dimethoxyphenyl)amino]-2-oxoethyl}-N-(thiophen-2-ylmethyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL192702
SMILES COc1cc(ccc1OC)NC(=O)Cn1nnc(c1N)C(=O)NCc1cccs1
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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 C18H20N6O4S MW 416.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O4S/c1-27-13-6-5-11(8-14(13)28-2)21-15(25)10-24-17(19)16(22-23-24)18(26)20-9-12-4-3-7-29-12/h3-8H,9-10,19H2,1-2H3,(H,20,26)(H,21,25)InChIKey
CPFCPVDSBBAFBN-UHFFFAOYSA-NSynonyms
5amino1(2((34dimethoxyphenyl)amino)2oxoethyl)N(thiophen2ylmethyl)1H123triazole4carboxamide
5amino1(2(34dimethoxyanilino)2oxoethyl)N(thiophen2ylmethyl)triazole4carboxamide
COC1=C(C=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)NCC3=CC=CS3)N)OC
InChI=1SC18H20N6O4Sc127136511(814(13)282)2115(25)102417(19)16(222324)18(26)209124372912h38H91019H212H3(H2026)(H2125)
MFCD14928056
ZINC000009226966
ZINC9226966
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