3-(2,5-dimethylphenyl)sulfanyl-2,2-dimethyl-1-piperazin-1-yl-propan-1-one

Systemtic Name: 3-(2,5-dimethylphenyl)sulfanyl-2,2-dimethyl-1-piperazin-1-yl-propan-1-one Openeye Name: 3-(2,5-dimethylphenyl)sulfanyl-2,2-dimethyl-1-piperazin-1-yl-propan-1-one CAS Name: 3-[(2,5-dimethylphenyl)thio]-2,2-dimethyl-1-(1-piperazinyl)-1-propanone IUPAC Name: 3-(2,5-dimethylphenyl)sulfanyl-2,2-dimethyl-1-piperazin-1-ylpropan-1-one Traditional Name: 3-[(2,5-dimethylphenyl)thio]-2,2-dimethyl-1-piperazino-propan-1-one Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(C)(C)C(=O)N2CCNCC2

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(C)(C)C(=O)N2CCNCC2

InChI

InChI=1S/C17H26N2OS/c1-13-5-6-14(2)15(11-13)21-12-17(3,4)16(20)19-9-7-18-8-10-19/h5-6,11,18H,7-10,12H2,1-4H3