5-[(3-methylthiophen-2-yl)methyl]-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: 5-[(3-methylthiophen-2-yl)methyl]-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: 5-[(3-methyl-2-thienyl)methyl]-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: 5-[(3-methyl-2-thiophenyl)methyl]-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: 5-[(3-methylthiophen-2-yl)methyl]-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: 5-[(3-methyl-2-thienyl)methyl]-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-1,5-benzothiazepine Formula: C24H27NO3S2 MolecularWeight: 441.60608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN2CCC(SC3=CC=CC=C32)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1=C(SC=C1)CN2CCC(SC3=CC=CC=C32)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C24H27NO3S2/c1-16-10-12-29-23(16)15-25-11-9-21(30-22-8-6-5-7-18(22)25)17-13-19(26-2)24(28-4)20(14-17)27-3/h5-8,10,12-14,21H,9,11,15H2,1-4H3