(phenylmethyl) N-[1-[[(2S)-1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[[(2S)-1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-[[(1S)-1-carbamoyl-3-methylsulfanyl-propyl]carbamoyl]butyl]carbamate CAS Name: N-[1-[[(2S)-1-amino-4-(methylthio)-1-oxobutan-2-yl]amino]-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-[[(1S)-1-carbamoyl-3-(methylthio)propyl]carbamoyl]butyl]carbamic acid benzyl ester Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(CCSC)C(=O)N)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCC(C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H27N3O4S/c1-3-7-15(17(23)20-14(16(19)22)10-11-26-2)21-18(24)25-12-13-8-5-4-6-9-13/h4-6,8-9,14-15H,3,7,10-12H2,1-2H3,(H2,19,22)(H,20,23)(H,21,24)/t14-,15?/m0/s1