5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiophene-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiophene-3-carboxamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]thiophene-3-carboxamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-thiophenecarboxamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]thiophene-3-carboxamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-thiophene-3-carboxamide Formula: C24H22N4O4S2 MolecularWeight: 494.58588

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CSC(=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CSC(=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H22N4O4S2/c1-27(14-21-25-20-9-5-4-8-19(20)23(29)26-21)24(30)18-12-22(33-15-18)34(31,32)28-11-10-16-6-2-3-7-17(16)13-28/h2-9,12,15H,10-11,13-14H2,1H3,(H,25,26,29)