3-[[(3aS,4R,8R,8aS)-5-[(3-aminocarbonylphenyl)methyl]-2,2-dimethyl-6-oxidanylidene-4,8-bis(phenylmethyl)-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzamide

Systemtic Name: 3-[[(3aS,4R,8R,8aS)-5-[(3-aminocarbonylphenyl)methyl]-2,2-dimethyl-6-oxidanylidene-4,8-bis(phenylmethyl)-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzamide Openeye Name: 3-[[(3aS,4R,8R,8aS)-4,8-dibenzyl-5-[(3-carbamoylphenyl)methyl]-2,2-dimethyl-6-oxo-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzamide CAS Name: 3-[[(3aS,4R,8R,8aS)-5-[(3-carbamoylphenyl)methyl]-2,2-dimethyl-6-oxo-4,8-bis(phenylmethyl)-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzamide IUPAC Name: 3-[[(3aS,4R,8R,8aS)-4,8-dibenzyl-5-[(3-carbamoylphenyl)methyl]-2,2-dimethyl-6-oxo-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzamide Traditional Name: 3-[[(3aS,4R,8R,8aS)-4,8-dibenzyl-5-(3-carbamoylbenzyl)-6-keto-2,2-dimethyl-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzamide Formula: C38H40N4O5 MolecularWeight: 632.748

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(N(C(=O)N(C(C2O1)CC3=CC=CC=C3)CC4=CC=CC(=C4)C(=O)N)CC5=CC=CC(=C5)C(=O)N)CC6=CC=CC=C6)C

Isomeric SMILES

CC1(O[C@H]2[C@H](N(C(=O)N([C@@H]([C@@H]2O1)CC3=CC=CC=C3)CC4=CC=CC(=C4)C(=O)N)CC5=CC=CC(=C5)C(=O)N)CC6=CC=CC=C6)C

InChI

InChI=1S/C38H40N4O5/c1-38(2)46-33-31(21-25-11-5-3-6-12-25)41(23-27-15-9-17-29(19-27)35(39)43)37(45)42(24-28-16-10-18-30(20-28)36(40)44)32(34(33)47-38)22-26-13-7-4-8-14-26/h3-20,31-34H,21-24H2,1-2H3,(H2,39,43)(H2,40,44)/t31-,32-,33+,34+/m1/s1