N,N-diethyl-2-[3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5-pyridin-2-yl-3H-1,4-benzodiazepin-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[3-[(3-methylphenyl)carbamoylamino]-2-oxidanylidene-5-pyridin-2-yl-3H-1,4-benzodiazepin-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[3-(m-tolylcarbamoylamino)-2-oxo-5-(2-pyridyl)-3H-1,4-benzodiazepin-1-yl]acetamide CAS Name: N,N-diethyl-2-[3-[[(3-methylanilino)-oxomethyl]amino]-2-oxo-5-(2-pyridinyl)-3H-1,4-benzodiazepin-1-yl]acetamide IUPAC Name: N,N-diethyl-2-[3-[(3-methylphenyl)carbamoylamino]-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-1-yl]acetamide Traditional Name: N,N-diethyl-2-[2-keto-3-(m-tolylcarbamoylamino)-5-(2-pyridyl)-3H-1,4-benzodiazepin-1-yl]acetamide Formula: C28H30N6O3 MolecularWeight: 498.5762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)C)C4=CC=CC=N4

Isomeric SMILES

CCN(CC)C(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)C)C4=CC=CC=N4

InChI

InChI=1S/C28H30N6O3/c1-4-33(5-2)24(35)18-34-23-15-7-6-13-21(23)25(22-14-8-9-16-29-22)31-26(27(34)36)32-28(37)30-20-12-10-11-19(3)17-20/h6-17,26H,4-5,18H2,1-3H3,(H2,30,32,37)