N-[4-[3-(naphthalen-2-ylmethyl)-8-nitro-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[4-[3-(naphthalen-2-ylmethyl)-8-nitro-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[4-[3-(2-naphthylmethyl)-8-nitro-2-oxo-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-(2-thienyl)acetamide CAS Name: N-[4-[3-(2-naphthalenylmethyl)-8-nitro-2-oxo-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[4-[3-(naphthalen-2-ylmethyl)-8-nitro-2-oxo-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-thiophen-2-ylacetamide Traditional Name: N-[4-[2-keto-3-(2-naphthylmethyl)-8-nitro-1,3-dihydro-1,4-benzodiazepin-5-yl]phenyl]-2-(2-thienyl)acetamide Formula: C32H24N4O4S MolecularWeight: 560.62236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC3C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])C(=N3)C5=CC=C(C=C5)NC(=O)CC6=CC=CS6

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC3C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])C(=N3)C5=CC=C(C=C5)NC(=O)CC6=CC=CS6

InChI

InChI=1S/C32H24N4O4S/c37-30(19-26-6-3-15-41-26)33-24-11-9-22(10-12-24)31-27-14-13-25(36(39)40)18-28(27)35-32(38)29(34-31)17-20-7-8-21-4-1-2-5-23(21)16-20/h1-16,18,29H,17,19H2,(H,33,37)(H,35,38)