1-[2-[6-oxidanylidene-3-(phenylmethyl)-2,5-dihydro-1H-1,2,4-triazin-5-yl]ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-[6-oxidanylidene-3-(phenylmethyl)-2,5-dihydro-1H-1,2,4-triazin-5-yl]ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[1-oxo-2-[6-oxo-3-(phenylmethyl)-2,5-dihydro-1H-1,2,4-triazin-5-yl]ethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-(3-benzyl-6-keto-2,5-dihydro-1H-1,2,4-triazin-5-yl)acetyl]amino]-3-phenyl-thiourea Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC(C(=O)NN2)CC(=O)NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC(C(=O)NN2)CC(=O)NNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C19H20N6O2S/c26-17(23-25-19(28)20-14-9-5-2-6-10-14)12-15-18(27)24-22-16(21-15)11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,21,22)(H,23,26)(H,24,27)(H2,20,25,28)