N-[4-[4-[5-(1,2-dithiolan-3-yl)pentanoyl]piperazin-1-yl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[4-[5-(1,2-dithiolan-3-yl)pentanoyl]piperazin-1-yl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-[5-(dithiolan-3-yl)pentanoyl]piperazin-1-yl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[4-[5-(3-dithiolanyl)-1-oxopentyl]-1-piperazinyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-[5-(dithiolan-3-yl)pentanoyl]piperazin-1-yl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[4-[5-(dithiolan-3-yl)pentanoyl]piperazino]phenyl]thiophene-2-carboxamide Formula: C23H29N3O2S3 MolecularWeight: 475.69026

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Descriptors Computed from Structure

Canonical SMILES:

C1CSSC1CCCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CSSC1CCCCC(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H29N3O2S3/c27-22(6-2-1-4-20-11-17-30-31-20)26-14-12-25(13-15-26)19-9-7-18(8-10-19)24-23(28)21-5-3-16-29-21/h3,5,7-10,16,20H,1-2,4,6,11-15,17H2,(H,24,28)