1-[4-[2-(4-nitroindazol-1-yl)carbonylhydrazinyl]phenyl]-3-phenyl-thiourea

Systemtic Name: 1-[4-[2-(4-nitroindazol-1-yl)carbonylhydrazinyl]phenyl]-3-phenyl-thiourea Openeye Name: 1-[4-[2-(4-nitroindazole-1-carbonyl)hydrazino]phenyl]-3-phenyl-thiourea CAS Name: 1-[4-[[(4-nitro-1-indazolyl)-oxomethyl]hydrazo]phenyl]-3-phenylthiourea IUPAC Name: 1-[4-[2-(4-nitroindazole-1-carbonyl)hydrazinyl]phenyl]-3-phenylthiourea Traditional Name: 1-[4-[N'-(4-nitroindazole-1-carbonyl)hydrazino]phenyl]-3-phenyl-thiourea Formula: C21H17N7O3S MolecularWeight: 447.46978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)NNC(=O)N3C4=C(C=N3)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)NNC(=O)N3C4=C(C=N3)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N7O3S/c29-21(27-18-7-4-8-19(28(30)31)17(18)13-22-27)26-25-16-11-9-15(10-12-16)24-20(32)23-14-5-2-1-3-6-14/h1-13,25H,(H,26,29)(H2,23,24,32)