methyl 3-[[4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]piperidin-1-yl]carbothioylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]piperidin-1-yl]carbothioylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbothioyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[4-[1-[(4-methoxyphenyl)methyl]-2-imidazolyl]-1-piperidinyl]-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]piperidine-1-carbothioyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[4-(1-p-anisylimidazol-2-yl)piperidine-1-carbothioyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C23H26N4O3S2 MolecularWeight: 470.60754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=C(SC=C4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=CN=C2C3CCN(CC3)C(=S)NC4=C(SC=C4)C(=O)OC

InChI

InChI=1S/C23H26N4O3S2/c1-29-18-5-3-16(4-6-18)15-27-13-10-24-21(27)17-7-11-26(12-8-17)23(31)25-19-9-14-32-20(19)22(28)30-2/h3-6,9-10,13-14,17H,7-8,11-12,15H2,1-2H3,(H,25,31)