7-chloranyl-5-(2,3-dimethoxyphenyl)-1-(2,2-dimethylpropyl)-3-methyl-5H-4,1-benzothiazepin-2-one

Systemtic Name: 7-chloranyl-5-(2,3-dimethoxyphenyl)-1-(2,2-dimethylpropyl)-3-methyl-5H-4,1-benzothiazepin-2-one Openeye Name: 7-chloro-5-(2,3-dimethoxyphenyl)-1-(2,2-dimethylpropyl)-3-methyl-5H-4,1-benzothiazepin-2-one CAS Name: 7-chloro-5-(2,3-dimethoxyphenyl)-1-(2,2-dimethylpropyl)-3-methyl-5H-4,1-benzothiazepin-2-one IUPAC Name: 7-chloro-5-(2,3-dimethoxyphenyl)-1-(2,2-dimethylpropyl)-3-methyl-5H-4,1-benzothiazepin-2-one Traditional Name: 7-chloro-5-(2,3-dimethoxyphenyl)-3-methyl-1-neopentyl-5H-4,1-benzothiazepin-2-one Formula: C23H28ClNO3S MolecularWeight: 433.99132

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(C=C(C=C2)Cl)C(S1)C3=C(C(=CC=C3)OC)OC)CC(C)(C)C

Isomeric SMILES

CC1C(=O)N(C2=C(C=C(C=C2)Cl)C(S1)C3=C(C(=CC=C3)OC)OC)CC(C)(C)C

InChI

InChI=1S/C23H28ClNO3S/c1-14-22(26)25(13-23(2,3)4)18-11-10-15(24)12-17(18)21(29-14)16-8-7-9-19(27-5)20(16)28-6/h7-12,14,21H,13H2,1-6H3