4-azanyl-N-[4-(4-chlorophenyl)butan-2-yl]-3-methyl-5-oxidanylidene-1,2,4-triazole-1-carboxamide

Systemtic Name: 4-azanyl-N-[4-(4-chlorophenyl)butan-2-yl]-3-methyl-5-oxidanylidene-1,2,4-triazole-1-carboxamide Openeye Name: 4-amino-N-[3-(4-chlorophenyl)-1-methyl-propyl]-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide CAS Name: 4-amino-N-[4-(4-chlorophenyl)butan-2-yl]-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide IUPAC Name: 4-amino-N-[4-(4-chlorophenyl)butan-2-yl]-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide Traditional Name: 4-amino-N-[3-(4-chlorophenyl)-1-methyl-propyl]-5-keto-3-methyl-1,2,4-triazole-1-carboxamide Formula: C14H18ClN5O2 MolecularWeight: 323.77802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1N)C(=O)NC(C)CCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=NN(C(=O)N1N)C(=O)NC(C)CCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H18ClN5O2/c1-9(3-4-11-5-7-12(15)8-6-11)17-13(21)20-14(22)19(16)10(2)18-20/h5-9H,3-4,16H2,1-2H3,(H,17,21)