4-chloranyl-N-[2-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide Openeye Name: N-[2-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)ethyl]-4-chloro-benzamide CAS Name: 4-chloro-N-[2-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide IUPAC Name: 4-chloro-N-[2-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide Traditional Name: N-[2-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)ethyl]-4-chloro-benzamide Formula: C14H15ClN4OS MolecularWeight: 322.8131

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NNC1=S)CCNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C=CCN1C(=NNC1=S)CCNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H15ClN4OS/c1-2-9-19-12(17-18-14(19)21)7-8-16-13(20)10-3-5-11(15)6-4-10/h2-6H,1,7-9H2,(H,16,20)(H,18,21)