1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea

Systemtic Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Openeye Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea CAS Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-[4-(2-pyrimidinylsulfamoyl)phenyl]thiourea IUPAC Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea Traditional Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-[4-(2-pyrimidylsulfamoyl)phenyl]thiourea Formula: C26H24N6O4S3 MolecularWeight: 580.70156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

InChI

InChI=1S/C26H24N6O4S3/c33-38(34,31-25-27-16-4-17-28-25)22-12-8-20(9-13-22)29-26(37)30-21-10-14-23(15-11-21)39(35,36)32-18-3-6-19-5-1-2-7-24(19)32/h1-2,4-5,7-17H,3,6,18H2,(H,27,28,31)(H2,29,30,37)