butyl N-[3-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate

Systemtic Name: butyl N-[3-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate Openeye Name: butyl N-[[3-[4-(2-amino-2-oxo-ethyl)phenyl]-5-isobutyl-2-thienyl]sulfonyl]carbamate CAS Name: N-[[3-[4-(2-amino-2-oxoethyl)phenyl]-5-(2-methylpropyl)-2-thiophenyl]sulfonyl]carbamic acid butyl ester IUPAC Name: butyl N-[3-[4-(2-amino-2-oxoethyl)phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate Traditional Name: N-[[3-[4-(2-amino-2-keto-ethyl)phenyl]-5-isobutyl-2-thienyl]sulfonyl]carbamic acid butyl ester Formula: C21H28N2O5S2 MolecularWeight: 452.58742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NS(=O)(=O)C1=C(C=C(S1)CC(C)C)C2=CC=C(C=C2)CC(=O)N

Isomeric SMILES

CCCCOC(=O)NS(=O)(=O)C1=C(C=C(S1)CC(C)C)C2=CC=C(C=C2)CC(=O)N

InChI

InChI=1S/C21H28N2O5S2/c1-4-5-10-28-21(25)23-30(26,27)20-18(13-17(29-20)11-14(2)3)16-8-6-15(7-9-16)12-19(22)24/h6-9,13-14H,4-5,10-12H2,1-3H3,(H2,22,24)(H,23,25)