2-(4-methylsulfanylphenyl)-N-[4-[(4-thiophen-2-ylcarbonyl-1,4-diazepan-1-yl)carbonyl]piperidin-4-yl]ethanamide

Systemtic Name: 2-(4-methylsulfanylphenyl)-N-[4-[(4-thiophen-2-ylcarbonyl-1,4-diazepan-1-yl)carbonyl]piperidin-4-yl]ethanamide Openeye Name: 2-(4-methylsulfanylphenyl)-N-[4-[4-(thiophene-2-carbonyl)-1,4-diazepane-1-carbonyl]-4-piperidyl]acetamide CAS Name: 2-[4-(methylthio)phenyl]-N-[4-[oxo-[4-[oxo(thiophen-2-yl)methyl]-1,4-diazepan-1-yl]methyl]-4-piperidinyl]acetamide IUPAC Name: 2-(4-methylsulfanylphenyl)-N-[4-[4-(thiophene-2-carbonyl)-1,4-diazepane-1-carbonyl]piperidin-4-yl]acetamide Traditional Name: 2-[4-(methylthio)phenyl]-N-[4-[4-(2-thenoyl)-1,4-diazepane-1-carbonyl]-4-piperidyl]acetamide Formula: C25H32N4O3S2 MolecularWeight: 500.67658

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC(=O)NC2(CCNCC2)C(=O)N3CCCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CSC1=CC=C(C=C1)CC(=O)NC2(CCNCC2)C(=O)N3CCCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H32N4O3S2/c1-33-20-7-5-19(6-8-20)18-22(30)27-25(9-11-26-12-10-25)24(32)29-14-3-13-28(15-16-29)23(31)21-4-2-17-34-21/h2,4-8,17,26H,3,9-16,18H2,1H3,(H,27,30)