(2-chloranylpyridin-4-yl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone

Systemtic Name: (2-chloranylpyridin-4-yl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Openeye Name: (2-chloro-4-pyridyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone CAS Name: (2-chloro-4-pyridinyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone IUPAC Name: (2-chloropyridin-4-yl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Traditional Name: (2-chloro-4-pyridyl)-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Formula: C16H15ClN2OS MolecularWeight: 318.8211

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C16H15ClN2OS/c1-11-7-9-19(13-4-2-3-5-14(13)21-11)16(20)12-6-8-18-15(17)10-12/h2-6,8,10-11H,7,9H2,1H3