1-(4-methoxyphenyl)-3-[3-[(4S)-5-oxidanylidene-1,4-dihydropyrazol-4-yl]propyl]thiourea

Systemtic Name: 1-(4-methoxyphenyl)-3-[3-[(4S)-5-oxidanylidene-1,4-dihydropyrazol-4-yl]propyl]thiourea Openeye Name: 1-(4-methoxyphenyl)-3-[3-[(4S)-5-oxo-1,4-dihydropyrazol-4-yl]propyl]thiourea CAS Name: 1-(4-methoxyphenyl)-3-[3-[(4S)-5-oxo-1,4-dihydropyrazol-4-yl]propyl]thiourea IUPAC Name: 1-(4-methoxyphenyl)-3-[3-[(4S)-5-oxo-1,4-dihydropyrazol-4-yl]propyl]thiourea Traditional Name: 1-[3-[(4S)-3-keto-2-pyrazolin-4-yl]propyl]-3-(4-methoxyphenyl)thiourea Formula: C14H18N4O2S MolecularWeight: 306.38332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCCCC2C=NNC2=O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCCC[C@H]2C=NNC2=O

InChI

InChI=1S/C14H18N4O2S/c1-20-12-6-4-11(5-7-12)17-14(21)15-8-2-3-10-9-16-18-13(10)19/h4-7,9-10H,2-3,8H2,1H3,(H,18,19)(H2,15,17,21)/t10-/m0/s1