(phenylmethyl) N-(2-azanyl-3-methyl-pentanoyl)-N-[(3-ethylsulfanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate

Systemtic Name: (phenylmethyl) N-(2-azanyl-3-methyl-pentanoyl)-N-[(3-ethylsulfanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate Openeye Name: benzyl N-(2-amino-3-methyl-pentanoyl)-N-[(3-ethylsulfanyl-4,5-dihydroisoxazol-5-yl)methyl]carbamate CAS Name: N-(2-amino-3-methyl-1-oxopentyl)-N-[[3-(ethylthio)-4,5-dihydroisoxazol-5-yl]methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2-amino-3-methylpentanoyl)-N-[(3-ethylsulfanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate Traditional Name: N-(2-amino-3-methyl-pentanoyl)-N-[[3-(ethylthio)-2-isoxazolin-5-yl]methyl]carbamic acid benzyl ester Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N(CC1CC(=NO1)SCC)C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CCC(C)C(C(=O)N(CC1CC(=NO1)SCC)C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C20H29N3O4S/c1-4-14(3)18(21)19(24)23(12-16-11-17(22-27-16)28-5-2)20(25)26-13-15-9-7-6-8-10-15/h6-10,14,16,18H,4-5,11-13,21H2,1-3H3