(phenylmethyl) N-[2-[(2-aminocarbonylphenyl)-methyl-amino]-1-(benzotriazol-2-yl)-2-oxidanylidene-ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[(2-aminocarbonylphenyl)-methyl-amino]-1-(benzotriazol-2-yl)-2-oxidanylidene-ethyl]carbamate Openeye Name: benzyl N-[1-(benzotriazol-2-yl)-2-(2-carbamoyl-N-methyl-anilino)-2-oxo-ethyl]carbamate CAS Name: N-[1-(2-benzotriazolyl)-2-(2-carbamoyl-N-methylanilino)-2-oxoethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(benzotriazol-2-yl)-2-(2-carbamoyl-N-methylanilino)-2-oxoethyl]carbamate Traditional Name: N-[1-(benzotriazol-2-yl)-2-(2-carbamoyl-N-methyl-anilino)-2-keto-ethyl]carbamic acid benzyl ester Formula: C24H22N6O4 MolecularWeight: 458.46928

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)N)C(=O)C(NC(=O)OCC2=CC=CC=C2)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)N)C(=O)C(NC(=O)OCC2=CC=CC=C2)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C24H22N6O4/c1-29(20-14-8-5-11-17(20)21(25)31)23(32)22(30-27-18-12-6-7-13-19(18)28-30)26-24(33)34-15-16-9-3-2-4-10-16/h2-14,22H,15H2,1H3,(H2,25,31)(H,26,33)