N-[7-chloranyl-1-methyl-2-oxidanylidene-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-3-yl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[7-chloranyl-1-methyl-2-oxidanylidene-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-3-yl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Openeye Name: N-[7-chloro-1-methyl-2-oxo-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-3-yl]-5-methyl-3-phenyl-isoxazole-4-carboxamide CAS Name: N-[7-chloro-1-methyl-2-oxo-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-3,4-dihydro-1,4-benzodiazepin-3-yl]-5-methyl-3-phenyl-4-isoxazolecarboxamide IUPAC Name: N-[7-chloro-1-methyl-2-oxo-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3,4-dihydro-1,4-benzodiazepin-3-yl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Traditional Name: N-[7-chloro-2-keto-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-1-methyl-3,4-dihydro-1,4-benzodiazepin-3-yl]-5-methyl-3-phenyl-isoxazole-4-carboxamide Formula: C27H21ClN4O4 MolecularWeight: 500.93304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3C(=O)N(C4=C(C=C(C=C4)Cl)C(=C5C=CC(=O)C=C5)N3)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3C(=O)N(C4=C(C=C(C=C4)Cl)C(=C5C=CC(=O)C=C5)N3)C

InChI

InChI=1S/C27H21ClN4O4/c1-15-22(24(31-36-15)16-6-4-3-5-7-16)26(34)30-25-27(35)32(2)21-13-10-18(28)14-20(21)23(29-25)17-8-11-19(33)12-9-17/h3-14,25,29H,1-2H3,(H,30,34)