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

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-thiochroman-4-yl-2-(1,2,4-triazol-1-yl)propanamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-thiochroman-4-yl-2-(1,2,4-triazol-1-yl)propionamide Formula: C14H16N4OS MolecularWeight: 288.36804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCSC2=CC=CC=C12)N3C=NC=N3

Isomeric SMILES

CC(C(=O)NC1CCSC2=CC=CC=C12)N3C=NC=N3

InChI

InChI=1S/C14H16N4OS/c1-10(18-9-15-8-16-18)14(19)17-12-6-7-20-13-5-3-2-4-11(12)13/h2-5,8-10,12H,6-7H2,1H3,(H,17,19)