3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]thiophene-2-carboxamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]thiophene-2-carboxamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(4,5-dimethyloxazol-2-yl)phenyl]thiophene-2-carboxamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(4,5-dimethyl-2-oxazolyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]thiophene-2-carboxamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(4,5-dimethyloxazol-2-yl)phenyl]thiophene-2-carboxamide Formula: C25H23N3O4S2 MolecularWeight: 493.59782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=N1)C2=CC=C(C=C2)NC(=O)C3=C(C=CS3)S(=O)(=O)N4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CC1=C(OC(=N1)C2=CC=C(C=C2)NC(=O)C3=C(C=CS3)S(=O)(=O)N4CCC5=CC=CC=C5C4)C

InChI

InChI=1S/C25H23N3O4S2/c1-16-17(2)32-25(26-16)19-7-9-21(10-8-19)27-24(29)23-22(12-14-33-23)34(30,31)28-13-11-18-5-3-4-6-20(18)15-28/h3-10,12,14H,11,13,15H2,1-2H3,(H,27,29)