4-chloranyl-N-[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]benzamide Openeye Name: N-[2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-4-chloro-benzamide CAS Name: 4-chloro-N-[1-oxo-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]ethyl]benzamide IUPAC Name: 4-chloro-N-[2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]benzamide Traditional Name: N-[2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-4-chloro-benzamide Formula: C19H16ClN5O2S MolecularWeight: 413.88064

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC(=O)C2=CC=C(C=C2)Cl)C3=CC=NC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC(=O)C2=CC=C(C=C2)Cl)C3=CC=NC=C3

InChI

InChI=1S/C19H16ClN5O2S/c1-2-11-25-17(13-7-9-21-10-8-13)23-24-19(25)28-12-16(26)22-18(27)14-3-5-15(20)6-4-14/h2-10H,1,11-12H2,(H,22,26,27)