1-(2-methoxy-5-methyl-phenyl)-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(2-methoxy-5-methyl-phenyl)-4-(4-thiazol-2-ylpiperazin-1-yl)butane-1,4-dione CAS Name: 1-(2-methoxy-5-methylphenyl)-4-[4-(2-thiazolyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(2-methoxy-5-methylphenyl)-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(2-methoxy-5-methyl-phenyl)-4-(4-thiazol-2-ylpiperazino)butane-1,4-dione Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)N2CCN(CC2)C3=NC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)N2CCN(CC2)C3=NC=CS3

InChI

InChI=1S/C19H23N3O3S/c1-14-3-5-17(25-2)15(13-14)16(23)4-6-18(24)21-8-10-22(11-9-21)19-20-7-12-26-19/h3,5,7,12-13H,4,6,8-11H2,1-2H3