7-chloranyl-5-(3-phenylmethoxypropyl)-1,5-dihydro-4,1-benzothiazepin-2-one

Systemtic Name: 7-chloranyl-5-(3-phenylmethoxypropyl)-1,5-dihydro-4,1-benzothiazepin-2-one Openeye Name: 5-(3-benzyloxypropyl)-7-chloro-1,5-dihydro-4,1-benzothiazepin-2-one CAS Name: 7-chloro-5-(3-phenylmethoxypropyl)-1,5-dihydro-4,1-benzothiazepin-2-one IUPAC Name: 7-chloro-5-(3-phenylmethoxypropyl)-1,5-dihydro-4,1-benzothiazepin-2-one Traditional Name: 5-(3-benzoxypropyl)-7-chloro-1,5-dihydro-4,1-benzothiazepin-2-one Formula: C19H20ClNO2S MolecularWeight: 361.8856

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)Cl)C(S1)CCCOCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)Cl)C(S1)CCCOCC3=CC=CC=C3

InChI

InChI=1S/C19H20ClNO2S/c20-15-8-9-17-16(11-15)18(24-13-19(22)21-17)7-4-10-23-12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11,18H,4,7,10,12-13H2,(H,21,22)