1-[[(2S)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoyl]amino]-3-(1-ethyl-5-methyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-[[(2S)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoyl]amino]-3-(1-ethyl-5-methyl-pyrazol-4-yl)thiourea Openeye Name: 1-[[(2S)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoyl]amino]-3-(1-ethyl-5-methyl-pyrazol-4-yl)thiourea CAS Name: 1-[[(2S)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-(1-ethyl-5-methyl-4-pyrazolyl)thiourea IUPAC Name: 1-[[(2S)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoyl]amino]-3-(1-ethyl-5-methylpyrazol-4-yl)thiourea Traditional Name: 1-[[(2S)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoyl]amino]-3-(1-ethyl-5-methyl-pyrazol-4-yl)thiourea Formula: C15H22N8O3S MolecularWeight: 394.45198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=S)NNC(=O)C(C)N2C(=C(C(=N2)C)[N+](=O)[O-])C)C

Isomeric SMILES

CCN1C(=C(C=N1)NC(=S)NNC(=O)[C@H](C)N2C(=C(C(=N2)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C15H22N8O3S/c1-6-21-9(3)12(7-16-21)17-15(27)19-18-14(24)11(5)22-10(4)13(23(25)26)8(2)20-22/h7,11H,6H2,1-5H3,(H,18,24)(H2,17,19,27)/t11-/m0/s1