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

Systemtic Name: 3-[3-[(3-cyanophenyl)methylsulfanyl]-5-(furan-2-yl)-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-[(3-cyanophenyl)methylsulfanyl]-5-(2-furyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[(3-cyanophenyl)methylthio]-5-(2-furanyl)-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[(3-cyanophenyl)methylsulfanyl]-5-(furan-2-yl)-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[(3-cyanobenzyl)thio]-5-(2-furyl)-1,2,4-triazol-4-yl]propionamide Formula: C17H15N5O2S MolecularWeight: 353.3983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NN=C(N2CCC(=O)N)C3=CC=CO3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NN=C(N2CCC(=O)N)C3=CC=CO3)C#N

InChI

InChI=1S/C17H15N5O2S/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)