N-(2-azanylethyl)-2-(4-fluorophenyl)-4-oxidanylidene-1-(2-thiophen-2-ylethanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: N-(2-azanylethyl)-2-(4-fluorophenyl)-4-oxidanylidene-1-(2-thiophen-2-ylethanoyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminoethyl)-2-(4-fluorophenyl)-4-oxo-1-[2-(2-thienyl)acetyl]-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminoethyl)-2-(4-fluorophenyl)-4-oxo-1-(1-oxo-2-thiophen-2-ylethyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminoethyl)-2-(4-fluorophenyl)-4-oxo-1-(2-thiophen-2-ylacetyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminoethyl)-2-(4-fluorophenyl)-4-keto-1-[2-(2-thienyl)acetyl]-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C24H23FN4O3S MolecularWeight: 466.527823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=C(C=C(C=C2)C(=O)NCCN)NC1=O)C(=O)CC3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(N(C2=C(C=C(C=C2)C(=O)NCCN)NC1=O)C(=O)CC3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H23FN4O3S/c25-17-6-3-15(4-7-17)21-14-22(30)28-19-12-16(24(32)27-10-9-26)5-8-20(19)29(21)23(31)13-18-2-1-11-33-18/h1-8,11-12,21H,9-10,13-14,26H2,(H,27,32)(H,28,30)