2-[(3S)-7-acetamido-2,5-bis(oxidanylidene)-3-phenyl-1,3-dihydro-1,4-benzodiazepin-4-yl]-N-tert-butyl-pentanamide

Systemtic Name: 2-[(3S)-7-acetamido-2,5-bis(oxidanylidene)-3-phenyl-1,3-dihydro-1,4-benzodiazepin-4-yl]-N-tert-butyl-pentanamide Openeye Name: 2-[(3S)-7-acetamido-2,5-dioxo-3-phenyl-1,3-dihydro-1,4-benzodiazepin-4-yl]-N-tert-butyl-pentanamide CAS Name: 2-[(3S)-7-acetamido-2,5-dioxo-3-phenyl-1,3-dihydro-1,4-benzodiazepin-4-yl]-N-tert-butylpentanamide IUPAC Name: 2-[(3S)-7-acetamido-2,5-dioxo-3-phenyl-1,3-dihydro-1,4-benzodiazepin-4-yl]-N-tert-butylpentanamide Traditional Name: 2-[(3S)-7-acetamido-2,5-diketo-3-phenyl-1,3-dihydro-1,4-benzodiazepin-4-yl]-N-tert-butyl-valeramide Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(C)(C)C)N1C(C(=O)NC2=C(C1=O)C=C(C=C2)NC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CCCC(C(=O)NC(C)(C)C)N1[C@H](C(=O)NC2=C(C1=O)C=C(C=C2)NC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C26H32N4O4/c1-6-10-21(23(32)29-26(3,4)5)30-22(17-11-8-7-9-12-17)24(33)28-20-14-13-18(27-16(2)31)15-19(20)25(30)34/h7-9,11-15,21-22H,6,10H2,1-5H3,(H,27,31)(H,28,33)(H,29,32)/t21?,22-/m0/s1