3-phenylpropylcarbamoyl N-(3-methylbutyl)-N-thiophen-2-ylcarbonyl-carbamate

Systemtic Name: 3-phenylpropylcarbamoyl N-(3-methylbutyl)-N-thiophen-2-ylcarbonyl-carbamate Openeye Name: 3-phenylpropylcarbamoyl N-isopentyl-N-(thiophene-2-carbonyl)carbamate CAS Name: N-(3-methylbutyl)-N-[oxo(thiophen-2-yl)methyl]carbamic acid [oxo-(3-phenylpropylamino)methyl] ester IUPAC Name: 3-phenylpropylcarbamoyl N-(3-methylbutyl)-N-(thiophene-2-carbonyl)carbamate Traditional Name: N-isoamyl-N-(2-thenoyl)carbamic acid 3-phenylpropylcarbamoyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C(=O)C1=CC=CS1)C(=O)OC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCN(C(=O)C1=CC=CS1)C(=O)OC(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O4S/c1-16(2)12-14-23(19(24)18-11-7-15-28-18)21(26)27-20(25)22-13-6-10-17-8-4-3-5-9-17/h3-5,7-9,11,15-16H,6,10,12-14H2,1-2H3,(H,22,25)