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

Systemtic Name: 1-[2-[[4-(4-bromophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-3-ethyl-thiourea Openeye Name: 1-[[2-[[4-(4-bromophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-ethyl-thiourea CAS Name: 1-[[2-[[4-(4-bromophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-3-ethylthiourea IUPAC Name: 1-[[2-[[4-(4-bromophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-ethylthiourea Traditional Name: 1-[[2-[[4-(4-bromophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetyl]amino]-3-ethyl-thiourea Formula: C19H19BrN6OS2 MolecularWeight: 491.42776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN6OS2/c1-2-21-18(28)24-22-16(27)12-29-19-25-23-17(13-6-4-3-5-7-13)26(19)15-10-8-14(20)9-11-15/h3-11H,2,12H2,1H3,(H,22,27)(H2,21,24,28)