2-(3,4-dimethoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-1-(4-phenylpiperazino)propan-1-one Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H26N2O3S/c1-16(27-18-9-10-19(25-2)20(15-18)26-3)21(24)23-13-11-22(12-14-23)17-7-5-4-6-8-17/h4-10,15-16H,11-14H2,1-3H3