(phenylmethyl) 2-[[1-[[5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[[1-[[5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[[1-[(1-formyl-4-guanidino-butyl)carbamoyl]-3-methyl-butyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[[1-[[5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[1-[[5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[1-[(1-formyl-4-guanidino-butyl)carbamoyl]-3-methyl-butyl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C25H38N6O5 MolecularWeight: 502.60642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCCN=C(N)N)C=O)NC(=O)C1CCCN1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)NC(CCCN=C(N)N)C=O)NC(=O)C1CCCN1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H38N6O5/c1-17(2)14-20(22(33)29-19(15-32)10-6-12-28-24(26)27)30-23(34)21-11-7-13-31(21)25(35)36-16-18-8-4-3-5-9-18/h3-5,8-9,15,17,19-21H,6-7,10-14,16H2,1-2H3,(H,29,33)(H,30,34)(H4,26,27,28)