3-(1,3-benzothiazol-2-yl)-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[(4S)-thiochroman-4-yl]propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[(4S)-thiochroman-4-yl]propionamide Formula: C19H18N2OS2 MolecularWeight: 354.48902

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CSC2=CC=CC=C2[C@H]1NC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H18N2OS2/c22-18(9-10-19-21-15-6-2-4-8-17(15)24-19)20-14-11-12-23-16-7-3-1-5-13(14)16/h1-8,14H,9-12H2,(H,20,22)/t14-/m0/s1