2-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoylamino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxopropyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylpropanoylamino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[2-[(4,8-dimethyl-2-quinolyl)thio]propanoylamino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)NC3=C(C(=C(S3)C)C)C(=O)N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SC(C)C(=O)NC3=C(C(=C(S3)C)C)C(=O)N

InChI

InChI=1S/C21H23N3O2S2/c1-10-7-6-8-15-11(2)9-16(23-18(10)15)27-14(5)20(26)24-21-17(19(22)25)12(3)13(4)28-21/h6-9,14H,1-5H3,(H2,22,25)(H,24,26)