N-[2-[4-[2-(4-propan-2-ylsulfanylphenyl)ethanoyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-[2-(4-propan-2-ylsulfanylphenyl)ethanoyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-[2-(4-isopropylsulfanylphenyl)acetyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-[1-oxo-2-[4-(propan-2-ylthio)phenyl]ethyl]-1-piperazinyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-[2-(4-propan-2-ylsulfanylphenyl)acetyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[4-[2-[4-(isopropylthio)phenyl]acetyl]piperazino]ethyl]thiophene-2-carboxamide Formula: C22H29N3O2S2 MolecularWeight: 431.61456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)N2CCN(CC2)CCNC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)N2CCN(CC2)CCNC(=O)C3=CC=CS3

InChI

InChI=1S/C22H29N3O2S2/c1-17(2)29-19-7-5-18(6-8-19)16-21(26)25-13-11-24(12-14-25)10-9-23-22(27)20-4-3-15-28-20/h3-8,15,17H,9-14,16H2,1-2H3,(H,23,27)