[4-(3-chlorophenyl)piperazin-1-yl]-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)methanone

Systemtic Name: [4-(3-chlorophenyl)piperazin-1-yl]-(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)methanone Openeye Name: [4-(3-chlorophenyl)piperazin-1-yl]-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)methanone CAS Name: [4-(3-chlorophenyl)-1-piperazinyl]-[4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]methanone IUPAC Name: [4-(3-chlorophenyl)piperazin-1-yl]-(4,5-dimethyl-2-pyrrol-1-ylthiophen-3-yl)methanone Traditional Name: [4-(3-chlorophenyl)piperazino]-(4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)methanone Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)N4C=CC=C4)C

InChI

InChI=1S/C21H22ClN3OS/c1-15-16(2)27-21(25-8-3-4-9-25)19(15)20(26)24-12-10-23(11-13-24)18-7-5-6-17(22)14-18/h3-9,14H,10-13H2,1-2H3