3-(2-chlorophenyl)-N-[4-(1,4-diazepan-1-ylcarbonyl)-2-methyl-phenyl]-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-N-[4-(1,4-diazepan-1-ylcarbonyl)-2-methyl-phenyl]-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-N-[4-(1,4-diazepane-1-carbonyl)-2-methyl-phenyl]-5-methyl-isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-N-[4-[1,4-diazepan-1-yl(oxo)methyl]-2-methylphenyl]-5-methyl-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-N-[4-(1,4-diazepane-1-carbonyl)-2-methylphenyl]-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-N-[4-(1,4-diazepane-1-carbonyl)-2-methyl-phenyl]-5-methyl-isoxazole-4-carboxamide Formula: C24H25ClN4O3 MolecularWeight: 452.9333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCCNCC2)NC(=O)C3=C(ON=C3C4=CC=CC=C4Cl)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCCNCC2)NC(=O)C3=C(ON=C3C4=CC=CC=C4Cl)C

InChI

InChI=1S/C24H25ClN4O3/c1-15-14-17(24(31)29-12-5-10-26-11-13-29)8-9-20(15)27-23(30)21-16(2)32-28-22(21)18-6-3-4-7-19(18)25/h3-4,6-9,14,26H,5,10-13H2,1-2H3,(H,27,30)