(3S)-6-chloranyl-N-(3-methylsulfanylphenyl)-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: (3S)-6-chloranyl-N-(3-methylsulfanylphenyl)-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: (3S)-6-chloro-N-(3-methylsulfanylphenyl)chromane-3-carboxamide CAS Name: (3S)-6-chloro-N-[3-(methylthio)phenyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: (3S)-6-chloro-N-(3-methylsulfanylphenyl)-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: (3S)-6-chloro-N-[3-(methylthio)phenyl]chroman-3-carboxamide Formula: C17H16ClNO2S MolecularWeight: 333.83244

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CC3=C(C=CC(=C3)Cl)OC2

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)[C@H]2CC3=C(C=CC(=C3)Cl)OC2

InChI

InChI=1S/C17H16ClNO2S/c1-22-15-4-2-3-14(9-15)19-17(20)12-7-11-8-13(18)5-6-16(11)21-10-12/h2-6,8-9,12H,7,10H2,1H3,(H,19,20)/t12-/m0/s1