N-[1-[(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]-1-oxidanylidene-propan-2-yl]octanamide

Systemtic Name: N-[1-[(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]-1-oxidanylidene-propan-2-yl]octanamide Openeye Name: N-[1-methyl-2-[(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]-2-oxo-ethyl]octanamide CAS Name: N-[1-[(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]-1-oxopropan-2-yl]octanamide IUPAC Name: N-[1-[(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]-1-oxopropan-2-yl]octanamide Traditional Name: N-[2-keto-2-[(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]-1-methyl-ethyl]caprylamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(C)C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C

Isomeric SMILES

CCCCCCCC(=O)NC(C)C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C

InChI

InChI=1S/C27H34N4O3/c1-4-5-6-7-11-18-23(32)28-19(2)26(33)30-25-27(34)31(3)22-17-13-12-16-21(22)24(29-25)20-14-9-8-10-15-20/h8-10,12-17,19,25H,4-7,11,18H2,1-3H3,(H,28,32)(H,30,33)