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

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)-3-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]thiourea Formula: C22H19BrClN3O2S2 MolecularWeight: 536.89216

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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=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C22H19BrClN3O2S2/c23-16-7-12-20(19(24)14-16)26-22(30)25-17-8-10-18(11-9-17)31(28,29)27-13-3-5-15-4-1-2-6-21(15)27/h1-2,4,6-12,14H,3,5,13H2,(H2,25,26,30)