S-[(2-methoxy-4,5-dimethyl-phenyl)amino] 4-(2-prop-1-en-2-ylphenyl)piperazine-1-carbothioate

Systemtic Name: S-[(2-methoxy-4,5-dimethyl-phenyl)amino] 4-(2-prop-1-en-2-ylphenyl)piperazine-1-carbothioate Openeye Name: S-(2-methoxy-4,5-dimethyl-anilino) 4-(2-isopropenylphenyl)piperazine-1-carbothioate CAS Name: 4-[2-(1-methylethenyl)phenyl]-1-piperazinecarbothioic acid S-(2-methoxy-4,5-dimethylanilino) ester IUPAC Name: S-(2-methoxy-4,5-dimethylanilino) 4-(2-prop-1-en-2-ylphenyl)piperazine-1-carbothioate Traditional Name: 4-(2-isopropenylphenyl)piperazine-1-carbothioic acid S-(2-methoxy-4,5-dimethyl-anilino) ester Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)OC)NSC(=O)N2CCN(CC2)C3=CC=CC=C3C(=C)C

Isomeric SMILES

CC1=CC(=C(C=C1C)OC)NSC(=O)N2CCN(CC2)C3=CC=CC=C3C(=C)C

InChI

InChI=1S/C23H29N3O2S/c1-16(2)19-8-6-7-9-21(19)25-10-12-26(13-11-25)23(27)29-24-20-14-17(3)18(4)15-22(20)28-5/h6-9,14-15,24H,1,10-13H2,2-5H3