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

Systemtic Name: S-[(3-methoxyquinoxalin-2-yl)amino] 4-(2-methoxyphenyl)piperazine-1-carbothioate Openeye Name: S-[(3-methoxyquinoxalin-2-yl)amino] 4-(2-methoxyphenyl)piperazine-1-carbothioate CAS Name: 4-(2-methoxyphenyl)-1-piperazinecarbothioic acid S-[(3-methoxy-2-quinoxalinyl)amino] ester IUPAC Name: S-[(3-methoxyquinoxalin-2-yl)amino] 4-(2-methoxyphenyl)piperazine-1-carbothioate Traditional Name: 4-(2-methoxyphenyl)piperazine-1-carbothioic acid S-[(3-methoxyquinoxalin-2-yl)amino] ester Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)SNC3=NC4=CC=CC=C4N=C3OC

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)SNC3=NC4=CC=CC=C4N=C3OC

InChI

InChI=1S/C21H23N5O3S/c1-28-18-10-6-5-9-17(18)25-11-13-26(14-12-25)21(27)30-24-19-20(29-2)23-16-8-4-3-7-15(16)22-19/h3-10H,11-14H2,1-2H3,(H,22,24)