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

Systemtic Name: N-[3-[4-(2,3-dihydro-1,4-benzodioxin-3-ylcarbonyl)piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[4-[2,3-dihydro-1,4-benzodioxin-3-yl(oxo)methyl]-1-piperazinyl]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[4-(2,3-dihydro-1,4-benzodioxin-3-carbonyl)piperazino]-3-keto-propyl]thiophene-3-carboxamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCNC(=O)C2=CSC=C2)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1C(=O)CCNC(=O)C2=CSC=C2)C(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H23N3O5S/c25-19(5-7-22-20(26)15-6-12-30-14-15)23-8-10-24(11-9-23)21(27)18-13-28-16-3-1-2-4-17(16)29-18/h1-4,6,12,14,18H,5,7-11,13H2,(H,22,26)