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

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2,5-dimethylthiophen-3-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2,5-dimethyl-3-thienyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(2,5-dimethyl-3-thiophenyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2,5-dimethylthiophen-3-yl)methanone Traditional Name: (2,5-dimethyl-3-thienyl)-(4-piperonylpiperazino)methanone Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H22N2O3S/c1-13-9-16(14(2)25-13)19(22)21-7-5-20(6-8-21)11-15-3-4-17-18(10-15)24-12-23-17/h3-4,9-10H,5-8,11-12H2,1-2H3