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

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(5-methyl-2-phenyltriazole-4-carbonyl)amino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]thiourea Formula: C18H17ClN6OS MolecularWeight: 400.88518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)C2=NN(N=C2C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)C2=NN(N=C2C)C3=CC=CC=C3

InChI

InChI=1S/C18H17ClN6OS/c1-11-14(19)9-6-10-15(11)20-18(27)22-21-17(26)16-12(2)23-25(24-16)13-7-4-3-5-8-13/h3-10H,1-2H3,(H,21,26)(H2,20,22,27)