1-(3-nitrophenyl)-3-[5-[(4-nitrophenyl)carbamothioylamino]pentyl]thiourea

Systemtic Name: 1-(3-nitrophenyl)-3-[5-[(4-nitrophenyl)carbamothioylamino]pentyl]thiourea Openeye Name: 1-(3-nitrophenyl)-3-[5-[(4-nitrophenyl)carbamothioylamino]pentyl]thiourea CAS Name: 1-[5-[[(3-nitroanilino)-sulfanylidenemethyl]amino]pentyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(3-nitrophenyl)-3-[5-[(4-nitrophenyl)carbamothioylamino]pentyl]thiourea Traditional Name: 1-(3-nitrophenyl)-3-[5-[(4-nitrophenyl)thiocarbamoylamino]pentyl]thiourea Formula: C19H22N6O4S2 MolecularWeight: 462.54578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NCCCCCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NCCCCCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H22N6O4S2/c26-24(27)16-9-7-14(8-10-16)22-18(30)20-11-2-1-3-12-21-19(31)23-15-5-4-6-17(13-15)25(28)29/h4-10,13H,1-3,11-12H2,(H2,20,22,30)(H2,21,23,31)