S-[(2-methoxyquinolin-3-yl)amino] 4-(3-methoxyphenyl)piperazine-1-carbothioate

Systemtic Name: S-[(2-methoxyquinolin-3-yl)amino] 4-(3-methoxyphenyl)piperazine-1-carbothioate Openeye Name: S-[(2-methoxy-3-quinolyl)amino] 4-(3-methoxyphenyl)piperazine-1-carbothioate CAS Name: 4-(3-methoxyphenyl)-1-piperazinecarbothioic acid S-[(2-methoxy-3-quinolinyl)amino] ester IUPAC Name: S-[(2-methoxyquinolin-3-yl)amino] 4-(3-methoxyphenyl)piperazine-1-carbothioate Traditional Name: 4-(3-methoxyphenyl)piperazine-1-carbothioic acid S-[(2-methoxy-3-quinolyl)amino] ester Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)SNC3=CC4=CC=CC=C4N=C3OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)SNC3=CC4=CC=CC=C4N=C3OC

InChI

InChI=1S/C22H24N4O3S/c1-28-18-8-5-7-17(15-18)25-10-12-26(13-11-25)22(27)30-24-20-14-16-6-3-4-9-19(16)23-21(20)29-2/h3-9,14-15,24H,10-13H2,1-2H3