1-phenyl-3-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]thiourea

Systemtic Name: 1-phenyl-3-[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]thiourea Openeye Name: 1-[[2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[1-oxo-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethyl]amino]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[[2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiourea Traditional Name: 1-[[2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-3-phenyl-thiourea Formula: C20H20N6OS2 MolecularWeight: 424.5424

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NNC(=S)NC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NNC(=S)NC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N6OS2/c1-2-13-26-18(15-9-5-3-6-10-15)23-25-20(26)29-14-17(27)22-24-19(28)21-16-11-7-4-8-12-16/h2-12H,1,13-14H2,(H,22,27)(H2,21,24,28)