1-(3,4-dimethylphenyl)-3-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[(5-methyl-2-phenyltriazole-4-carbonyl)amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]thiourea Formula: C19H20N6OS MolecularWeight: 380.4667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=NN(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=NN(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C19H20N6OS/c1-12-9-10-15(11-13(12)2)20-19(27)22-21-18(26)17-14(3)23-25(24-17)16-7-5-4-6-8-16/h4-11H,1-3H3,(H,21,26)(H2,20,22,27)