N-[2-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]-1-piperazinyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]piperazin-1-yl]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[4-[2-(1,3-benzothiazol-2-ylthio)acetyl]piperazino]ethyl]thiophene-2-carboxamide Formula: C20H22N4O2S3 MolecularWeight: 446.60928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC=CS2)C(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC=CS2)C(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H22N4O2S3/c25-18(14-28-20-22-15-4-1-2-5-16(15)29-20)24-11-9-23(10-12-24)8-7-21-19(26)17-6-3-13-27-17/h1-6,13H,7-12,14H2,(H,21,26)