N-[1-[[2-(oxan-2-yl)-3-oxidanylidene-1,2-oxazol-5-yl]methyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-1H-indole-2-carboxamide

Systemtic Name: N-[1-[[2-(oxan-2-yl)-3-oxidanylidene-1,2-oxazol-5-yl]methyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-1H-indole-2-carboxamide Openeye Name: N-[2-oxo-1-[(3-oxo-2-tetrahydropyran-2-yl-isoxazol-5-yl)methyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]-1H-indole-2-carboxamide CAS Name: N-[1-[[2-(2-oxanyl)-3-oxo-5-isoxazolyl]methyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-1H-indole-2-carboxamide IUPAC Name: N-[1-[[2-(oxan-2-yl)-3-oxo-1,2-oxazol-5-yl]methyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-1H-indole-2-carboxamide Traditional Name: N-[2-keto-1-[(3-keto-2-tetrahydropyran-2-yl-4-isoxazolin-5-yl)methyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]-1H-indole-2-carboxamide Formula: C33H29N5O5 MolecularWeight: 575.61386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2C(=O)C=C(O2)CN3C4=CC=CC=C4C(=NC(C3=O)NC(=O)C5=CC6=CC=CC=C6N5)C7=CC=CC=C7

Isomeric SMILES

C1CCOC(C1)N2C(=O)C=C(O2)CN3C4=CC=CC=C4C(=NC(C3=O)NC(=O)C5=CC6=CC=CC=C6N5)C7=CC=CC=C7

InChI

InChI=1S/C33H29N5O5/c39-28-19-23(43-38(28)29-16-8-9-17-42-29)20-37-27-15-7-5-13-24(27)30(21-10-2-1-3-11-21)35-31(33(37)41)36-32(40)26-18-22-12-4-6-14-25(22)34-26/h1-7,10-15,18-19,29,31,34H,8-9,16-17,20H2,(H,36,40)