1-[(2,8-dimethylquinolin-4-yl)carbonylamino]-3-(4-ethoxyphenyl)thiourea

Systemtic Name: 1-[(2,8-dimethylquinolin-4-yl)carbonylamino]-3-(4-ethoxyphenyl)thiourea Openeye Name: 1-[(2,8-dimethylquinoline-4-carbonyl)amino]-3-(4-ethoxyphenyl)thiourea CAS Name: 1-[[(2,8-dimethyl-4-quinolinyl)-oxomethyl]amino]-3-(4-ethoxyphenyl)thiourea IUPAC Name: 1-[(2,8-dimethylquinoline-4-carbonyl)amino]-3-(4-ethoxyphenyl)thiourea Traditional Name: 1-[(2,8-dimethylquinoline-4-carbonyl)amino]-3-p-phenetyl-thiourea Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=NC3=C2C=CC=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=NC3=C2C=CC=C3C)C

InChI

InChI=1S/C21H22N4O2S/c1-4-27-16-10-8-15(9-11-16)23-21(28)25-24-20(26)18-12-14(3)22-19-13(2)6-5-7-17(18)19/h5-12H,4H2,1-3H3,(H,24,26)(H2,23,25,28)