[2-methyl-1-(3-thiophen-3-ylphenyl)propan-2-yl] N-[(2S)-1-oxidanylidenehexan-2-yl]carbamate

Systemtic Name: [2-methyl-1-(3-thiophen-3-ylphenyl)propan-2-yl] N-[(2S)-1-oxidanylidenehexan-2-yl]carbamate Openeye Name: [1,1-dimethyl-2-[3-(3-thienyl)phenyl]ethyl] N-[(1S)-1-formylpentyl]carbamate CAS Name: N-[(2S)-1-oxohexan-2-yl]carbamic acid [2-methyl-1-[3-(3-thiophenyl)phenyl]propan-2-yl] ester IUPAC Name: [2-methyl-1-(3-thiophen-3-ylphenyl)propan-2-yl] N-[(2S)-1-oxohexan-2-yl]carbamate Traditional Name: N-[(1S)-1-formylpentyl]carbamic acid [1,1-dimethyl-2-[3-(3-thienyl)phenyl]ethyl] ester Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=O)NC(=O)OC(C)(C)CC1=CC=CC(=C1)C2=CSC=C2

Isomeric SMILES

CCCC[C@@H](C=O)NC(=O)OC(C)(C)CC1=CC=CC(=C1)C2=CSC=C2

InChI

InChI=1S/C21H27NO3S/c1-4-5-9-19(14-23)22-20(24)25-21(2,3)13-16-7-6-8-17(12-16)18-10-11-26-15-18/h6-8,10-12,14-15,19H,4-5,9,13H2,1-3H3,(H,22,24)/t19-/m0/s1