N-[3-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[4-(1-benzofuran-2-ylcarbonyl)piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[4-(benzofuran-2-carbonyl)piperazin-1-yl]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[4-[2-benzofuranyl(oxo)methyl]-1-piperazinyl]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[4-(1-benzofuran-2-carbonyl)piperazin-1-yl]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[4-(benzofuran-2-carbonyl)piperazino]-3-keto-propyl]thiophene-3-carboxamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCNC(=O)C2=CSC=C2)C(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1C(=O)CCNC(=O)C2=CSC=C2)C(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H21N3O4S/c25-19(5-7-22-20(26)16-6-12-29-14-16)23-8-10-24(11-9-23)21(27)18-13-15-3-1-2-4-17(15)28-18/h1-4,6,12-14H,5,7-11H2,(H,22,26)