7-methyl-4-(3-methylbutanoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-methyl-4-(3-methylbutanoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 7-methyl-4-(3-methylbutanoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 7-methyl-4-(3-methyl-1-oxobutyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-methyl-4-(3-methylbutanoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-isovaleryl-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CC=C3)C(=O)CC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)CN(C2C3=CC=CC=C3)C(=O)CC(C)C

InChI

InChI=1S/C21H24N2O2/c1-14(2)11-20(25)23-13-19(24)22-18-10-9-15(3)12-17(18)21(23)16-7-5-4-6-8-16/h4-10,12,14,21H,11,13H2,1-3H3,(H,22,24)