2-methylpropyl 2-[2,4-bis(oxidanylidene)-5-phenyl-3-(phenylcarbamoylamino)-1,5-benzodiazepin-1-yl]ethanoate

Systemtic Name: 2-methylpropyl 2-[2,4-bis(oxidanylidene)-5-phenyl-3-(phenylcarbamoylamino)-1,5-benzodiazepin-1-yl]ethanoate Openeye Name: isobutyl 2-[2,4-dioxo-5-phenyl-3-(phenylcarbamoylamino)-1,5-benzodiazepin-1-yl]acetate CAS Name: 2-[3-[[anilino(oxo)methyl]amino]-2,4-dioxo-5-phenyl-1,5-benzodiazepin-1-yl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[2,4-dioxo-5-phenyl-3-(phenylcarbamoylamino)-1,5-benzodiazepin-1-yl]acetate Traditional Name: 2-[2,4-diketo-5-phenyl-3-(phenylcarbamoylamino)-1,5-benzodiazepin-1-yl]acetic acid isobutyl ester Formula: C28H28N4O5 MolecularWeight: 500.54572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CN1C2=CC=CC=C2N(C(=O)C(C1=O)NC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC(=O)CN1C2=CC=CC=C2N(C(=O)C(C1=O)NC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H28N4O5/c1-19(2)18-37-24(33)17-31-22-15-9-10-16-23(22)32(21-13-7-4-8-14-21)27(35)25(26(31)34)30-28(36)29-20-11-5-3-6-12-20/h3-16,19,25H,17-18H2,1-2H3,(H2,29,30,36)