1-(2,3-dimethylphenyl)-3-[(2,7-dimethylquinolin-3-yl)carbonylamino]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[(2,7-dimethylquinolin-3-yl)carbonylamino]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[(2,7-dimethylquinoline-3-carbonyl)amino]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[[(2,7-dimethyl-3-quinolinyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[(2,7-dimethylquinoline-3-carbonyl)amino]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[(2,7-dimethylquinoline-3-carbonyl)amino]thiourea Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C(=O)NNC(=S)NC3=CC=CC(=C3C)C)C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C(=O)NNC(=S)NC3=CC=CC(=C3C)C)C

InChI

InChI=1S/C21H22N4OS/c1-12-8-9-16-11-17(15(4)22-19(16)10-12)20(26)24-25-21(27)23-18-7-5-6-13(2)14(18)3/h5-11H,1-4H3,(H,24,26)(H2,23,25,27)