7-chloranyl-5-prop-2-ynyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 7-chloranyl-5-prop-2-ynyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 7-chloro-5-prop-2-ynyl-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 7-chloro-5-prop-2-ynyl-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 7-chloro-5-prop-2-ynyl-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 7-chloro-5-propargyl-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C12H10ClNOS MolecularWeight: 251.7319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)CCSC2=C1C=C(C=C2)Cl

Isomeric SMILES

C#CCN1C(=O)CCSC2=C1C=C(C=C2)Cl

InChI

InChI=1S/C12H10ClNOS/c1-2-6-14-10-8-9(13)3-4-11(10)16-7-5-12(14)15/h1,3-4,8H,5-7H2