2-[4-(4-chlorophenyl)sulfanylbutanoylamino]-N,4,5-trimethyl-thiophene-3-carboxamide

Systemtic Name: 2-[4-(4-chlorophenyl)sulfanylbutanoylamino]-N,4,5-trimethyl-thiophene-3-carboxamide Openeye Name: 2-[4-(4-chlorophenyl)sulfanylbutanoylamino]-N,4,5-trimethyl-thiophene-3-carboxamide CAS Name: 2-[[4-[(4-chlorophenyl)thio]-1-oxobutyl]amino]-N,4,5-trimethyl-3-thiophenecarboxamide IUPAC Name: 2-[4-(4-chlorophenyl)sulfanylbutanoylamino]-N,4,5-trimethylthiophene-3-carboxamide Traditional Name: 2-[4-[(4-chlorophenyl)thio]butanoylamino]-N,4,5-trimethyl-thiophene-3-carboxamide Formula: C18H21ClN2O2S2 MolecularWeight: 396.95454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NC)NC(=O)CCCSC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NC)NC(=O)CCCSC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C18H21ClN2O2S2/c1-11-12(2)25-18(16(11)17(23)20-3)21-15(22)5-4-10-24-14-8-6-13(19)7-9-14/h6-9H,4-5,10H2,1-3H3,(H,20,23)(H,21,22)