N-[3-chloranyl-4-[cyano(phenyl)methyl]phenyl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[3-chloranyl-4-[cyano(phenyl)methyl]phenyl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[3-chloro-4-[cyano(phenyl)methyl]phenyl]-5-methyl-2-phenyl-triazole-4-carboxamide CAS Name: N-[3-chloro-4-[cyano(phenyl)methyl]phenyl]-5-methyl-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[3-chloro-4-[cyano(phenyl)methyl]phenyl]-5-methyl-2-phenyltriazole-4-carboxamide Traditional Name: N-[3-chloro-4-[cyano(phenyl)methyl]phenyl]-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C24H18ClN5O MolecularWeight: 427.88562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2=CC(=C(C=C2)C(C#N)C3=CC=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2=CC(=C(C=C2)C(C#N)C3=CC=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C24H18ClN5O/c1-16-23(29-30(28-16)19-10-6-3-7-11-19)24(31)27-18-12-13-20(22(25)14-18)21(15-26)17-8-4-2-5-9-17/h2-14,21H,1H3,(H,27,31)