ethyl N-[4-methyl-1-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]pentan-2-yl]carbamate

Systemtic Name: ethyl N-[4-methyl-1-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]pentan-2-yl]carbamate Openeye Name: ethyl N-[3-methyl-1-[[4-[methyl(2-thienylsulfonyl)amino]butanoylamino]methyl]butyl]carbamate CAS Name: N-[4-methyl-1-[[4-[methyl(thiophen-2-ylsulfonyl)amino]-1-oxobutyl]amino]pentan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-methyl-1-[4-[methyl(thiophen-2-ylsulfonyl)amino]butanoylamino]pentan-2-yl]carbamate Traditional Name: N-[3-methyl-1-[[4-[methyl(2-thienylsulfonyl)amino]butanoylamino]methyl]butyl]carbamic acid ethyl ester Formula: C18H31N3O5S2 MolecularWeight: 433.58584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC(C)C)CNC(=O)CCCN(C)S(=O)(=O)C1=CC=CS1

Isomeric SMILES

CCOC(=O)NC(CC(C)C)CNC(=O)CCCN(C)S(=O)(=O)C1=CC=CS1

InChI

InChI=1S/C18H31N3O5S2/c1-5-26-18(23)20-15(12-14(2)3)13-19-16(22)8-6-10-21(4)28(24,25)17-9-7-11-27-17/h7,9,11,14-15H,5-6,8,10,12-13H2,1-4H3,(H,19,22)(H,20,23)