2-[2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxamide

Systemtic Name: 2-[2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxamide Openeye Name: 2-[2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-4-(p-tolyl)thiophene-3-carboxamide CAS Name: 2-[[2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-1-oxopropyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxamide IUPAC Name: 2-[2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxamide Traditional Name: 2-[2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]propanoylamino]-4-(p-tolyl)thiophene-3-carboxamide Formula: C19H22N6O2S2 MolecularWeight: 430.54698

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C(C)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C)C(=O)N)N

Isomeric SMILES

CCSC1=NN=C(N1C(C)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C)C(=O)N)N

InChI

InChI=1S/C19H22N6O2S2/c1-4-28-19-24-23-18(21)25(19)11(3)16(27)22-17-14(15(20)26)13(9-29-17)12-7-5-10(2)6-8-12/h5-9,11H,4H2,1-3H3,(H2,20,26)(H2,21,23)(H,22,27)