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

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-3-(1-methylpyrazol-4-yl)propanamide Openeye Name: N-(6-chlorothiochroman-4-yl)-3-(1-methylpyrazol-4-yl)propanamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(1-methyl-4-pyrazolyl)propanamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-3-(1-methylpyrazol-4-yl)propanamide Traditional Name: N-(6-chlorothiochroman-4-yl)-3-(1-methylpyrazol-4-yl)propionamide Formula: C16H18ClN3OS MolecularWeight: 335.85162

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CCC(=O)NC2CCSC3=C2C=C(C=C3)Cl

Isomeric SMILES

CN1C=C(C=N1)CCC(=O)NC2CCSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN3OS/c1-20-10-11(9-18-20)2-5-16(21)19-14-6-7-22-15-4-3-12(17)8-13(14)15/h3-4,8-10,14H,2,5-7H2,1H3,(H,19,21)