S-[(2-methoxy-5,6-dimethyl-pyridin-3-yl)amino] 4-(4-methylphenyl)piperazine-1-carbothioate

Systemtic Name: S-[(2-methoxy-5,6-dimethyl-pyridin-3-yl)amino] 4-(4-methylphenyl)piperazine-1-carbothioate Openeye Name: S-[(2-methoxy-5,6-dimethyl-3-pyridyl)amino] 4-(p-tolyl)piperazine-1-carbothioate CAS Name: 4-(4-methylphenyl)-1-piperazinecarbothioic acid S-[(2-methoxy-5,6-dimethyl-3-pyridinyl)amino] ester IUPAC Name: S-[(2-methoxy-5,6-dimethylpyridin-3-yl)amino] 4-(4-methylphenyl)piperazine-1-carbothioate Traditional Name: 4-(p-tolyl)piperazine-1-carbothioic acid S-[(2-methoxy-5,6-dimethyl-3-pyridyl)amino] ester Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)C(=O)SNC3=C(N=C(C(=C3)C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)C(=O)SNC3=C(N=C(C(=C3)C)C)OC

InChI

InChI=1S/C20H26N4O2S/c1-14-5-7-17(8-6-14)23-9-11-24(12-10-23)20(25)27-22-18-13-15(2)16(3)21-19(18)26-4/h5-8,13,22H,9-12H2,1-4H3