N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(1,2,4-triazol-1-yl)propanamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-(6-chlorothiochroman-4-yl)-2-(1,2,4-triazol-1-yl)propanamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-2-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-(6-chlorothiochroman-4-yl)-2-(1,2,4-triazol-1-yl)propionamide Formula: C14H15ClN4OS MolecularWeight: 322.8131

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCSC2=C1C=C(C=C2)Cl)N3C=NC=N3

Isomeric SMILES

CC(C(=O)NC1CCSC2=C1C=C(C=C2)Cl)N3C=NC=N3

InChI

InChI=1S/C14H15ClN4OS/c1-9(19-8-16-7-17-19)14(20)18-12-4-5-21-13-3-2-10(15)6-11(12)13/h2-3,6-9,12H,4-5H2,1H3,(H,18,20)