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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NNC(=S)N1CC=C)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C1=NNC(=S)N1CC=C)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H15ClN4OS/c1-3-8-19-12(17-18-14(19)21)9(2)16-13(20)10-4-6-11(15)7-5-10/h3-7,9H,1,8H2,2H3,(H,16,20)(H,18,21)