S-[(5-ethanoyl-2-methoxy-4-methyl-phenyl)amino] 4-(3,5-dimethylphenyl)piperazine-1-carbothioate

Systemtic Name: S-[(5-ethanoyl-2-methoxy-4-methyl-phenyl)amino] 4-(3,5-dimethylphenyl)piperazine-1-carbothioate Openeye Name: S-(5-acetyl-2-methoxy-4-methyl-anilino) 4-(3,5-dimethylphenyl)piperazine-1-carbothioate CAS Name: 4-(3,5-dimethylphenyl)-1-piperazinecarbothioic acid S-(5-acetyl-2-methoxy-4-methylanilino) ester IUPAC Name: S-(5-acetyl-2-methoxy-4-methylanilino) 4-(3,5-dimethylphenyl)piperazine-1-carbothioate Traditional Name: 4-(3,5-dimethylphenyl)piperazine-1-carbothioic acid S-(5-acetyl-2-methoxy-4-methyl-anilino) ester Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3S/c1-15-10-16(2)12-19(11-15)25-6-8-26(9-7-25)23(28)30-24-21-14-20(18(4)27)17(3)13-22(21)29-5/h10-14,24H,6-9H2,1-5H3