N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-4-ethanoyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-4-ethanoyl-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-(6-chlorothiochroman-4-yl)-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-(6-chlorothiochroman-4-yl)-1H-pyrrole-2-carboxamide Formula: C16H15ClN2O2S MolecularWeight: 334.8205

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC2CCSC3=C2C=C(C=C3)Cl

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)NC2CCSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C16H15ClN2O2S/c1-9(20)10-6-14(18-8-10)16(21)19-13-4-5-22-15-3-2-11(17)7-12(13)15/h2-3,6-8,13,18H,4-5H2,1H3,(H,19,21)