(phenylmethyl) N-[(2S)-1-[(5-chloranylthiophen-2-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(5-chloranylthiophen-2-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(5-chloro-2-thienyl)methylcarbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(5-chloro-2-thiophenyl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(5-chlorothiophen-2-yl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(5-chloro-2-thienyl)methylcarbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C18H21ClN2O3S MolecularWeight: 380.88894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(S1)Cl)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=C(S1)Cl)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H21ClN2O3S/c1-12(2)16(17(22)20-10-14-8-9-15(19)25-14)21-18(23)24-11-13-6-4-3-5-7-13/h3-9,12,16H,10-11H2,1-2H3,(H,20,22)(H,21,23)/t16-/m0/s1