N-[(3-methyl-3H-1,2-thiazol-2-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-[(3-methyl-3H-1,2-thiazol-2-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[(3-methyl-3H-isothiazol-2-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-(2-mercaptophenyl)-N-[(3-methyl-3H-isothiazol-2-yl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[(3-methyl-3H-1,2-thiazol-2-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-(2-mercaptophenyl)-N-[(3-methyl-4-isothiazolin-2-yl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C22H23N3OS2 MolecularWeight: 409.56752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=CSN1CN(C2=CC=CC=C2S)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CC1C=CSN1CN(C2=CC=CC=C2S)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C22H23N3OS2/c1-16-11-13-28-25(16)15-24(20-8-4-5-9-21(20)27)22(26)18-10-12-23-19-7-3-2-6-17(19)14-18/h2-9,11,13-14,16,23,27H,10,12,15H2,1H3