8-chloranyl-7-methyl-3,4-dihydro-2H-1,4-benzothiazepin-5-one

Systemtic Name: 8-chloranyl-7-methyl-3,4-dihydro-2H-1,4-benzothiazepin-5-one Openeye Name: 8-chloro-7-methyl-3,4-dihydro-2H-1,4-benzothiazepin-5-one CAS Name: 8-chloro-7-methyl-3,4-dihydro-2H-1,4-benzothiazepin-5-one IUPAC Name: 8-chloro-7-methyl-3,4-dihydro-2H-1,4-benzothiazepin-5-one Traditional Name: 8-chloro-7-methyl-3,4-dihydro-2H-1,4-benzothiazepin-5-one Formula: C10H10ClNOS MolecularWeight: 227.7105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)NCCS2)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)NCCS2)Cl

InChI

InChI=1S/C10H10ClNOS/c1-6-4-7-9(5-8(6)11)14-3-2-12-10(7)13/h4-5H,2-3H2,1H3,(H,12,13)