2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]butanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]butanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[3-cyano-4-(4-methoxyphenyl)-2-thienyl]butanamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-[3-cyano-4-(4-methoxyphenyl)-2-thiophenyl]butanamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[3-cyano-4-(4-methoxyphenyl)thiophen-2-yl]butanamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-[3-cyano-4-(4-methoxyphenyl)-2-thienyl]butyramide Formula: C19H20N6O2S2 MolecularWeight: 428.5311

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)OC)C#N)N3C(=NN=C3SC)N

Isomeric SMILES

CCC(C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)OC)C#N)N3C(=NN=C3SC)N

InChI

InChI=1S/C19H20N6O2S2/c1-4-15(25-18(21)23-24-19(25)28-3)16(26)22-17-13(9-20)14(10-29-17)11-5-7-12(27-2)8-6-11/h5-8,10,15H,4H2,1-3H3,(H2,21,23)(H,22,26)