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

Systemtic Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(3-nitrophenyl)thiourea Formula: C22H20N4O4S2 MolecularWeight: 468.5486

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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(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O4S2/c27-26(28)19-8-3-7-18(15-19)24-22(31)23-17-10-12-20(13-11-17)32(29,30)25-14-4-6-16-5-1-2-9-21(16)25/h1-3,5,7-13,15H,4,6,14H2,(H2,23,24,31)