[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylphenyl]-thiophen-2-yl-methanone

Systemtic Name: [2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylphenyl]-thiophen-2-yl-methanone Openeye Name: [2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenyl]-(2-thienyl)methanone CAS Name: [2-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]phenyl]-thiophen-2-ylmethanone IUPAC Name: [2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]phenyl]-thiophen-2-ylmethanone Traditional Name: [2-(4-piperonylpiperazine-1-carbonyl)phenyl]-(2-thienyl)methanone Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4C(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4C(=O)C5=CC=CS5

InChI

InChI=1S/C24H22N2O4S/c27-23(22-6-3-13-31-22)18-4-1-2-5-19(18)24(28)26-11-9-25(10-12-26)15-17-7-8-20-21(14-17)30-16-29-20/h1-8,13-14H,9-12,15-16H2