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

Systemtic Name: S-[(2-methoxyquinolin-3-yl)amino] 4-(2-methoxyphenyl)piperazine-1-carbothioate Openeye Name: S-[(2-methoxy-3-quinolyl)amino] 4-(2-methoxyphenyl)piperazine-1-carbothioate CAS Name: 4-(2-methoxyphenyl)-1-piperazinecarbothioic acid S-[(2-methoxy-3-quinolinyl)amino] ester IUPAC Name: S-[(2-methoxyquinolin-3-yl)amino] 4-(2-methoxyphenyl)piperazine-1-carbothioate Traditional Name: 4-(2-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=C1N2CCN(CC2)C(=O)SNC3=CC4=CC=CC=C4N=C3OC

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)SNC3=CC4=CC=CC=C4N=C3OC

InChI

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