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

Systemtic Name: 2-[3-[(3-aminophenyl)carbamoylamino]-5-(morpholin-4-ylmethyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[3-[(3-aminophenyl)carbamoylamino]-5-(morpholinomethyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[3-[[(3-aminoanilino)-oxomethyl]amino]-5-(4-morpholinylmethyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]-N-methyl-N-phenylacetamide IUPAC Name: 2-[3-[(3-aminophenyl)carbamoylamino]-5-(morpholin-4-ylmethyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]-N-methyl-N-phenylacetamide Traditional Name: 2-[3-[(3-aminophenyl)carbamoylamino]-2-keto-5-(morpholinomethyl)-3H-1,4-benzodiazepin-1-yl]-N-methyl-N-phenyl-acetamide Formula: C30H33N7O4 MolecularWeight: 555.62752

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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)N)CN5CCOCC5

Isomeric SMILES

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

InChI

InChI=1S/C30H33N7O4/c1-35(23-10-3-2-4-11-23)27(38)20-37-26-13-6-5-12-24(26)25(19-36-14-16-41-17-15-36)33-28(29(37)39)34-30(40)32-22-9-7-8-21(31)18-22/h2-13,18,28H,14-17,19-20,31H2,1H3,(H2,32,34,40)