(phenylmethyl) N-(2-oxidanylidene-5-pyrazin-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl)carbamate

Systemtic Name: (phenylmethyl) N-(2-oxidanylidene-5-pyrazin-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl)carbamate Openeye Name: benzyl N-(2-oxo-5-pyrazin-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl)carbamate CAS Name: N-[2-oxo-5-(2-pyrazinyl)-1,3-dihydro-1,4-benzodiazepin-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2-oxo-5-pyrazin-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl)carbamate Traditional Name: N-(2-keto-5-pyrazin-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl)carbamic acid benzyl ester Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2C(=O)NC3=CC=CC=C3C(=N2)C4=NC=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2C(=O)NC3=CC=CC=C3C(=N2)C4=NC=CN=C4

InChI

InChI=1S/C21H17N5O3/c27-20-19(26-21(28)29-13-14-6-2-1-3-7-14)25-18(17-12-22-10-11-23-17)15-8-4-5-9-16(15)24-20/h1-12,19H,13H2,(H,24,27)(H,26,28)