1-[[1-(3-nitrophenyl)pyrazol-3-yl]carbonylamino]-3-(2-thiophen-2-ylethyl)thiourea

Systemtic Name: 1-[[1-(3-nitrophenyl)pyrazol-3-yl]carbonylamino]-3-(2-thiophen-2-ylethyl)thiourea Openeye Name: 1-[[1-(3-nitrophenyl)pyrazole-3-carbonyl]amino]-3-[2-(2-thienyl)ethyl]thiourea CAS Name: 1-[[[1-(3-nitrophenyl)-3-pyrazolyl]-oxomethyl]amino]-3-(2-thiophen-2-ylethyl)thiourea IUPAC Name: 1-[[1-(3-nitrophenyl)pyrazole-3-carbonyl]amino]-3-(2-thiophen-2-ylethyl)thiourea Traditional Name: 1-[[1-(3-nitrophenyl)pyrazole-3-carbonyl]amino]-3-[2-(2-thienyl)ethyl]thiourea Formula: C17H16N6O3S2 MolecularWeight: 416.47734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=CC(=N2)C(=O)NNC(=S)NCCC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C=CC(=N2)C(=O)NNC(=S)NCCC3=CC=CS3

InChI

InChI=1S/C17H16N6O3S2/c24-16(19-20-17(27)18-8-6-14-5-2-10-28-14)15-7-9-22(21-15)12-3-1-4-13(11-12)23(25)26/h1-5,7,9-11H,6,8H2,(H,19,24)(H2,18,20,27)