1-(4-butylphenyl)-3-[(2-methylquinolin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(2-methylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(2-methylquinoline-4-carbonyl)amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[(2-methyl-4-quinolinyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(2-methylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(2-methylquinoline-4-carbonyl)amino]thiourea Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C22H24N4OS/c1-3-4-7-16-10-12-17(13-11-16)24-22(28)26-25-21(27)19-14-15(2)23-20-9-6-5-8-18(19)20/h5-6,8-14H,3-4,7H2,1-2H3,(H,25,27)(H2,24,26,28)