methyl N-[4,5-dimethyl-2-(3-phenylsulfanylpropanoylamino)thiophen-3-yl]carbonylcarbamate

Systemtic Name: methyl N-[4,5-dimethyl-2-(3-phenylsulfanylpropanoylamino)thiophen-3-yl]carbonylcarbamate Openeye Name: methyl N-[4,5-dimethyl-2-(3-phenylsulfanylpropanoylamino)thiophene-3-carbonyl]carbamate CAS Name: N-[[4,5-dimethyl-2-[[1-oxo-3-(phenylthio)propyl]amino]-3-thiophenyl]-oxomethyl]carbamic acid methyl ester IUPAC Name: methyl N-[4,5-dimethyl-2-(3-phenylsulfanylpropanoylamino)thiophene-3-carbonyl]carbamate Traditional Name: N-[4,5-dimethyl-2-[3-(phenylthio)propanoylamino]thiophene-3-carbonyl]carbamic acid methyl ester Formula: C18H20N2O4S2 MolecularWeight: 392.4924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NC(=O)OC)NC(=O)CCSC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NC(=O)OC)NC(=O)CCSC2=CC=CC=C2)C

InChI

InChI=1S/C18H20N2O4S2/c1-11-12(2)26-17(15(11)16(22)20-18(23)24-3)19-14(21)9-10-25-13-7-5-4-6-8-13/h4-8H,9-10H2,1-3H3,(H,19,21)(H,20,22,23)