3-[3-[(3-cyanophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-[(3-cyanophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-[(3-cyanophenyl)methylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[(3-cyanophenyl)methylthio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[(3-cyanophenyl)methylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[(3-cyanobenzyl)thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]propionamide Formula: C17H15N5OS2 MolecularWeight: 369.4639

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NN=C(N2CCC(=O)N)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NN=C(N2CCC(=O)N)C3=CC=CS3)C#N

InChI

InChI=1S/C17H15N5OS2/c18-10-12-3-1-4-13(9-12)11-25-17-21-20-16(14-5-2-8-24-14)22(17)7-6-15(19)23/h1-5,8-9H,6-7,11H2,(H2,19,23)