methyl N-[2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonylamino]thiophen-3-yl]carbonylcarbamate

Systemtic Name: methyl N-[2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]carbonylamino]thiophen-3-yl]carbonylcarbamate Openeye Name: methyl N-[2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]thiophene-3-carbonyl]carbamate CAS Name: N-[[2-[[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-oxomethyl]amino]-3-thiophenyl]-oxomethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]thiophene-3-carbonyl]carbamate Traditional Name: N-[2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]thiophene-3-carbonyl]carbamic acid methyl ester Formula: C23H21N3O6S2 MolecularWeight: 499.55934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)C1=C(SC=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC(=O)NC(=O)C1=C(SC=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H21N3O6S2/c1-32-23(29)25-21(28)19-11-13-33-22(19)24-20(27)16-6-8-18(9-7-16)34(30,31)26-12-10-15-4-2-3-5-17(15)14-26/h2-9,11,13H,10,12,14H2,1H3,(H,24,27)(H,25,28,29)