N-methyl-2-[5-(morpholin-4-ylmethyl)-2-oxidanylidene-3-(phenylcarbamoylamino)-3H-1,4-benzodiazepin-1-yl]-N-phenyl-ethanamide

Systemtic Name: N-methyl-2-[5-(morpholin-4-ylmethyl)-2-oxidanylidene-3-(phenylcarbamoylamino)-3H-1,4-benzodiazepin-1-yl]-N-phenyl-ethanamide Openeye Name: N-methyl-2-[5-(morpholinomethyl)-2-oxo-3-(phenylcarbamoylamino)-3H-1,4-benzodiazepin-1-yl]-N-phenyl-acetamide CAS Name: 2-[3-[[anilino(oxo)methyl]amino]-5-(4-morpholinylmethyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]-N-methyl-N-phenylacetamide IUPAC Name: N-methyl-2-[5-(morpholin-4-ylmethyl)-2-oxo-3-(phenylcarbamoylamino)-3H-1,4-benzodiazepin-1-yl]-N-phenylacetamide Traditional Name: 2-[2-keto-5-(morpholinomethyl)-3-(phenylcarbamoylamino)-3H-1,4-benzodiazepin-1-yl]-N-methyl-N-phenyl-acetamide Formula: C30H32N6O4 MolecularWeight: 540.61288

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=CC=C4)CN5CCOCC5

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=CC=C4)CN5CCOCC5

InChI

InChI=1S/C30H32N6O4/c1-34(23-12-6-3-7-13-23)27(37)21-36-26-15-9-8-14-24(26)25(20-35-16-18-40-19-17-35)32-28(29(36)38)33-30(39)31-22-10-4-2-5-11-22/h2-15,28H,16-21H2,1H3,(H2,31,33,39)