1-[2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-3-ethyl-thiourea

Systemtic Name: 1-[2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-3-ethyl-thiourea Openeye Name: 1-[[2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-ethyl-thiourea CAS Name: 1-[[2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-3-ethylthiourea IUPAC Name: 1-[[2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-ethylthiourea Traditional Name: 1-[[2-[[5-(4-tert-butylphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetyl]amino]-3-ethyl-thiourea Formula: C23H28N6OS2 MolecularWeight: 468.63802

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCNC(=S)NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H28N6OS2/c1-5-24-21(31)27-25-19(30)15-32-22-28-26-20(29(22)18-9-7-6-8-10-18)16-11-13-17(14-12-16)23(2,3)4/h6-14H,5,15H2,1-4H3,(H,25,30)(H2,24,27,31)