(phenylmethyl) N-(3-methylbutyl)-N-[[(2S)-1-oxidanylidene-4-phenyl-1-thiophen-2-yl-butan-2-yl]carbamoyl]carbamate

Systemtic Name: (phenylmethyl) N-(3-methylbutyl)-N-[[(2S)-1-oxidanylidene-4-phenyl-1-thiophen-2-yl-butan-2-yl]carbamoyl]carbamate Openeye Name: benzyl N-isopentyl-N-[[(1S)-3-phenyl-1-(thiophene-2-carbonyl)propyl]carbamoyl]carbamate CAS Name: N-(3-methylbutyl)-N-[oxo-[[(2S)-1-oxo-4-phenyl-1-thiophen-2-ylbutan-2-yl]amino]methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(3-methylbutyl)-N-[[(2S)-1-oxo-4-phenyl-1-thiophen-2-ylbutan-2-yl]carbamoyl]carbamate Traditional Name: N-isoamyl-N-[[(1S)-3-phenyl-1-(2-thenoyl)propyl]carbamoyl]carbamic acid benzyl ester Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C(=O)NC(CCC1=CC=CC=C1)C(=O)C2=CC=CS2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN(C(=O)N[C@@H](CCC1=CC=CC=C1)C(=O)C2=CC=CS2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H32N2O4S/c1-21(2)17-18-30(28(33)34-20-23-12-7-4-8-13-23)27(32)29-24(26(31)25-14-9-19-35-25)16-15-22-10-5-3-6-11-22/h3-14,19,21,24H,15-18,20H2,1-2H3,(H,29,32)/t24-/m0/s1