N-[4-oxidanylidene-4-[2-(4-phenylpiperazin-1-yl)ethylamino]butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[2-(4-phenylpiperazin-1-yl)ethylamino]butyl]thiophene-3-carboxamide Openeye Name: N-[4-oxo-4-[2-(4-phenylpiperazin-1-yl)ethylamino]butyl]thiophene-3-carboxamide CAS Name: N-[4-oxo-4-[2-(4-phenyl-1-piperazinyl)ethylamino]butyl]-3-thiophenecarboxamide IUPAC Name: N-[4-oxo-4-[2-(4-phenylpiperazin-1-yl)ethylamino]butyl]thiophene-3-carboxamide Traditional Name: N-[4-keto-4-[2-(4-phenylpiperazino)ethylamino]butyl]thiophene-3-carboxamide Formula: C21H28N4O2S MolecularWeight: 400.53762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)CCCNC(=O)C2=CSC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCNC(=O)CCCNC(=O)C2=CSC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O2S/c26-20(7-4-9-23-21(27)18-8-16-28-17-18)22-10-11-24-12-14-25(15-13-24)19-5-2-1-3-6-19/h1-3,5-6,8,16-17H,4,7,9-15H2,(H,22,26)(H,23,27)