1-[(4-methoxyquinolin-2-yl)carbonylamino]-3-(3,4,5-trimethoxyphenyl)thiourea

Systemtic Name: 1-[(4-methoxyquinolin-2-yl)carbonylamino]-3-(3,4,5-trimethoxyphenyl)thiourea Openeye Name: 1-[(4-methoxyquinoline-2-carbonyl)amino]-3-(3,4,5-trimethoxyphenyl)thiourea CAS Name: 1-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-3-(3,4,5-trimethoxyphenyl)thiourea IUPAC Name: 1-[(4-methoxyquinoline-2-carbonyl)amino]-3-(3,4,5-trimethoxyphenyl)thiourea Traditional Name: 1-[(4-methoxyquinoline-2-carbonyl)amino]-3-(3,4,5-trimethoxyphenyl)thiourea Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NNC(=O)C2=NC3=CC=CC=C3C(=C2)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NNC(=O)C2=NC3=CC=CC=C3C(=C2)OC

InChI

InChI=1S/C21H22N4O5S/c1-27-16-11-15(23-14-8-6-5-7-13(14)16)20(26)24-25-21(31)22-12-9-17(28-2)19(30-4)18(10-12)29-3/h5-11H,1-4H3,(H,24,26)(H2,22,25,31)