[4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-phenyl-5-piperidin-1-yl-thiophen-2-yl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-phenyl-5-piperidin-1-yl-thiophen-2-yl)methanone Openeye Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-[4-phenyl-5-(1-piperidyl)-2-thienyl]methanone CAS Name: [4-(2,5-dimethylphenyl)-1-piperazinyl]-[4-phenyl-5-(1-piperidinyl)-2-thiophenyl]methanone IUPAC Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-phenyl-5-piperidin-1-ylthiophen-2-yl)methanone Traditional Name: [4-(2,5-dimethylphenyl)piperazino]-(4-phenyl-5-piperidino-2-thienyl)methanone Formula: C28H33N3OS MolecularWeight: 459.64612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC(=C(S3)N4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC(=C(S3)N4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H33N3OS/c1-21-11-12-22(2)25(19-21)29-15-17-30(18-16-29)27(32)26-20-24(23-9-5-3-6-10-23)28(33-26)31-13-7-4-8-14-31/h3,5-6,9-12,19-20H,4,7-8,13-18H2,1-2H3