2-(cyclopropylmethyl)-N-[5-(4-methoxyphenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-3-oxidanyl-heptanamide

Systemtic Name: 2-(cyclopropylmethyl)-N-[5-(4-methoxyphenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-3-oxidanyl-heptanamide Openeye Name: 2-(cyclopropylmethyl)-3-hydroxy-N-[5-(4-methoxyphenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]heptanamide CAS Name: 2-(cyclopropylmethyl)-3-hydroxy-N-[5-(4-methoxyphenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]heptanamide IUPAC Name: 2-(cyclopropylmethyl)-3-hydroxy-N-[5-(4-methoxyphenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]heptanamide Traditional Name: 2-(cyclopropylmethyl)-3-hydroxy-N-[2-keto-5-(4-methoxyphenyl)-1-methyl-3H-1,4-benzodiazepin-3-yl]enanthamide Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC1CC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)OC)C)O

Isomeric SMILES

CCCCC(C(CC1CC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=C(C=C4)OC)C)O

InChI

InChI=1S/C28H35N3O4/c1-4-5-10-24(32)22(17-18-11-12-18)27(33)30-26-28(34)31(2)23-9-7-6-8-21(23)25(29-26)19-13-15-20(35-3)16-14-19/h6-9,13-16,18,22,24,26,32H,4-5,10-12,17H2,1-3H3,(H,30,33)