4-(3-methyl-1-benzothiophen-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine

Systemtic Name: 4-(3-methyl-1-benzothiophen-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine Openeye Name: 4-(3-methylbenzothiophen-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine CAS Name: 4-(3-methyl-1-benzothiophen-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine IUPAC Name: 4-(3-methyl-1-benzothiophen-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine Traditional Name: 4-(3-methylbenzothiophen-2-yl)-2,3,4,5-tetrahydro-1,5-benzothiazepine Formula: C18H17NS2 MolecularWeight: 311.46428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3CCSC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3CCSC4=CC=CC=C4N3

InChI

InChI=1S/C18H17NS2/c1-12-13-6-2-4-8-16(13)21-18(12)15-10-11-20-17-9-5-3-7-14(17)19-15/h2-9,15,19H,10-11H2,1H3