1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(2-pyridazin-3-ylethyl)thiourea

Systemtic Name: 1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(2-pyridazin-3-ylethyl)thiourea Openeye Name: 1-[4-(3-nitrophenyl)thiazol-2-yl]-3-(2-pyridazin-3-ylethyl)thiourea CAS Name: 1-[4-(3-nitrophenyl)-2-thiazolyl]-3-[2-(3-pyridazinyl)ethyl]thiourea IUPAC Name: 1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(2-pyridazin-3-ylethyl)thiourea Traditional Name: 1-[4-(3-nitrophenyl)thiazol-2-yl]-3-(2-pyridazin-3-ylethyl)thiourea Formula: C16H14N6O2S2 MolecularWeight: 386.45136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC(=S)NCCC3=NN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)NC(=S)NCCC3=NN=CC=C3

InChI

InChI=1S/C16H14N6O2S2/c23-22(24)13-5-1-3-11(9-13)14-10-26-16(19-14)20-15(25)17-8-6-12-4-2-7-18-21-12/h1-5,7,9-10H,6,8H2,(H2,17,19,20,25)