1-[(Z)-N-[(4-methylphenyl)sulfonylmethyl]-C-phenyl-carbonimidoyl]-3-(5H-1,2,4-triazin-4-yl)thiourea

Systemtic Name: 1-[(Z)-N-[(4-methylphenyl)sulfonylmethyl]-C-phenyl-carbonimidoyl]-3-(5H-1,2,4-triazin-4-yl)thiourea Openeye Name: 1-[(Z)-C-phenyl-N-(p-tolylsulfonylmethyl)carbonimidoyl]-3-(5H-1,2,4-triazin-4-yl)thiourea CAS Name: 1-[(Z)-(4-methylphenyl)sulfonylmethylimino-phenylmethyl]-3-(5H-1,2,4-triazin-4-yl)thiourea IUPAC Name: 1-[(Z)-N-[(4-methylphenyl)sulfonylmethyl]-C-phenylcarbonimidoyl]-3-(5H-1,2,4-triazin-4-yl)thiourea Traditional Name: 1-[(Z)-C-phenyl-N-(tosylmethyl)carbonimidoyl]-3-(5H-1,2,4-triazin-4-yl)thiourea Formula: C19H20N6O2S2 MolecularWeight: 428.5311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CN=C(C2=CC=CC=C2)NC(=S)NN3CC=NN=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C/N=C(/C2=CC=CC=C2)\NC(=S)NN3CC=NN=C3

InChI

InChI=1S/C19H20N6O2S2/c1-15-7-9-17(10-8-15)29(26,27)14-20-18(16-5-3-2-4-6-16)23-19(28)24-25-12-11-21-22-13-25/h2-11,13H,12,14H2,1H3,(H2,20,23,24,28)