1-(4-nitrophenyl)-3-[4-[4-[(4-nitrophenyl)carbamothioylamino]phenyl]phenyl]thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-[4-[4-[(4-nitrophenyl)carbamothioylamino]phenyl]phenyl]thiourea Openeye Name: 1-(4-nitrophenyl)-3-[4-[4-[(4-nitrophenyl)carbamothioylamino]phenyl]phenyl]thiourea CAS Name: 1-[4-[4-[[(4-nitroanilino)-sulfanylidenemethyl]amino]phenyl]phenyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(4-nitrophenyl)-3-[4-[4-[(4-nitrophenyl)carbamothioylamino]phenyl]phenyl]thiourea Traditional Name: 1-(4-nitrophenyl)-3-[4-[4-[(4-nitrophenyl)thiocarbamoylamino]phenyl]phenyl]thiourea Formula: C26H20N6O4S2 MolecularWeight: 544.6048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])NC(=S)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])NC(=S)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H20N6O4S2/c33-31(34)23-13-9-21(10-14-23)29-25(37)27-19-5-1-17(2-6-19)18-3-7-20(8-4-18)28-26(38)30-22-11-15-24(16-12-22)32(35)36/h1-16H,(H2,27,29,37)(H2,28,30,38)