N-[4-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[oxo-[4-[2-(phenylthio)ethyl]-1-piperazinyl]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[4-[2-(phenylthio)ethyl]piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C24H25N3O2S2 MolecularWeight: 451.6042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCSC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CCSC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C24H25N3O2S2/c28-23(22-7-4-17-31-22)25-20-10-8-19(9-11-20)24(29)27-14-12-26(13-15-27)16-18-30-21-5-2-1-3-6-21/h1-11,17H,12-16,18H2,(H,25,28)