N-(1-methyl-2-oxidanylidene-5-thiophen-2-yl-3H-1,4-benzodiazepin-3-yl)-2-(2-phenylethanoylamino)propanamide

Systemtic Name: N-(1-methyl-2-oxidanylidene-5-thiophen-2-yl-3H-1,4-benzodiazepin-3-yl)-2-(2-phenylethanoylamino)propanamide Openeye Name: N-[1-methyl-2-oxo-5-(2-thienyl)-3H-1,4-benzodiazepin-3-yl]-2-[(2-phenylacetyl)amino]propanamide CAS Name: N-(1-methyl-2-oxo-5-thiophen-2-yl-3H-1,4-benzodiazepin-3-yl)-2-[(1-oxo-2-phenylethyl)amino]propanamide IUPAC Name: N-(1-methyl-2-oxo-5-thiophen-2-yl-3H-1,4-benzodiazepin-3-yl)-2-[(2-phenylacetyl)amino]propanamide Traditional Name: N-[2-keto-1-methyl-5-(2-thienyl)-3H-1,4-benzodiazepin-3-yl]-2-[(2-phenylacetyl)amino]propionamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CS3)C)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CS3)C)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O3S/c1-16(26-21(30)15-17-9-4-3-5-10-17)24(31)28-23-25(32)29(2)19-12-7-6-11-18(19)22(27-23)20-13-8-14-33-20/h3-14,16,23H,15H2,1-2H3,(H,26,30)(H,28,31)