3-(3,4-dimethylphenyl)-1-[4-(4,5-dimethyl-1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one

Systemtic Name: 3-(3,4-dimethylphenyl)-1-[4-(4,5-dimethyl-1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one Openeye Name: 3-(3,4-dimethylphenyl)-1-[4-(4,5-dimethylthiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one CAS Name: 3-(3,4-dimethylphenyl)-1-[4-(4,5-dimethyl-2-thiazolyl)-1-piperazinyl]-2-propyn-1-one IUPAC Name: 3-(3,4-dimethylphenyl)-1-[4-(4,5-dimethyl-1,3-thiazol-2-yl)piperazin-1-yl]prop-2-yn-1-one Traditional Name: 3-(3,4-dimethylphenyl)-1-[4-(4,5-dimethylthiazol-2-yl)piperazino]prop-2-yn-1-one Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C#CC(=O)N2CCN(CC2)C3=NC(=C(S3)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C#CC(=O)N2CCN(CC2)C3=NC(=C(S3)C)C)C

InChI

InChI=1S/C20H23N3OS/c1-14-5-6-18(13-15(14)2)7-8-19(24)22-9-11-23(12-10-22)20-21-16(3)17(4)25-20/h5-6,13H,9-12H2,1-4H3