1-[2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)ethanoylamino]-3-(3-methylphenyl)thiourea

Systemtic Name: 1-[2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)ethanoylamino]-3-(3-methylphenyl)thiourea Openeye Name: 1-[[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-(m-tolyl)thiourea CAS Name: 1-[[2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]-3-(3-methylphenyl)thiourea IUPAC Name: 1-[[2-(4-chloro-3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-(3-methylphenyl)thiourea Traditional Name: 1-[[2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)acetyl]amino]-3-(m-tolyl)thiourea Formula: C15H18ClN5OS MolecularWeight: 351.85432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NNC(=O)CN2C(=C(C(=N2)C)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NNC(=O)CN2C(=C(C(=N2)C)Cl)C

InChI

InChI=1S/C15H18ClN5OS/c1-9-5-4-6-12(7-9)17-15(23)19-18-13(22)8-21-11(3)14(16)10(2)20-21/h4-7H,8H2,1-3H3,(H,18,22)(H2,17,19,23)