N-(3-cyanophenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(3-cyanophenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(3-cyanophenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(3-cyanophenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(3-cyanophenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(3-cyanophenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)SC2=NN=CN2C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C#N)SC2=NN=CN2C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H17N5O2S/c1-13(18(25)22-15-5-3-4-14(10-15)11-20)27-19-23-21-12-24(19)16-6-8-17(26-2)9-7-16/h3-10,12-13H,1-2H3,(H,22,25)