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

Systemtic Name: 4-azanyl-N-[4-(3-chlorophenyl)butan-2-yl]-3-(dimethylamino)-5-oxidanylidene-1,2,4-triazole-1-carboxamide Openeye Name: 4-amino-N-[3-(3-chlorophenyl)-1-methyl-propyl]-3-(dimethylamino)-5-oxo-1,2,4-triazole-1-carboxamide CAS Name: 4-amino-N-[4-(3-chlorophenyl)butan-2-yl]-3-(dimethylamino)-5-oxo-1,2,4-triazole-1-carboxamide IUPAC Name: 4-amino-N-[4-(3-chlorophenyl)butan-2-yl]-3-(dimethylamino)-5-oxo-1,2,4-triazole-1-carboxamide Traditional Name: 4-amino-N-[3-(3-chlorophenyl)-1-methyl-propyl]-3-(dimethylamino)-5-keto-1,2,4-triazole-1-carboxamide Formula: C15H21ClN6O2 MolecularWeight: 352.81924

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC(=CC=C1)Cl)NC(=O)N2C(=O)N(C(=N2)N(C)C)N

Isomeric SMILES

CC(CCC1=CC(=CC=C1)Cl)NC(=O)N2C(=O)N(C(=N2)N(C)C)N

InChI

InChI=1S/C15H21ClN6O2/c1-10(7-8-11-5-4-6-12(16)9-11)18-14(23)22-15(24)21(17)13(19-22)20(2)3/h4-6,9-10H,7-8,17H2,1-3H3,(H,18,23)