1-(3,4-dimethylphenyl)-3-[(6-methoxy-2-methyl-quinolin-3-yl)carbonylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[(6-methoxy-2-methyl-quinolin-3-yl)carbonylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[(6-methoxy-2-methyl-quinoline-3-carbonyl)amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[(6-methoxy-2-methyl-3-quinolinyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[(6-methoxy-2-methylquinoline-3-carbonyl)amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[(6-methoxy-2-methyl-quinoline-3-carbonyl)amino]thiourea Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=C(N=C3C=CC(=CC3=C2)OC)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=C(N=C3C=CC(=CC3=C2)OC)C)C

InChI

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