N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxidanylidene-propyl]-N-butan-2-yl-benzamide

Systemtic Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxidanylidene-propyl]-N-butan-2-yl-benzamide Openeye Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxo-propyl]-N-sec-butyl-benzamide CAS Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxopropyl]-N-butan-2-ylbenzamide IUPAC Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxopropyl]-N-butan-2-ylbenzamide Traditional Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-keto-propyl]-N-sec-butyl-benzamide Formula: C22H23BrN4O2S MolecularWeight: 487.41262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CCC(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(C)N(CCC(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23BrN4O2S/c1-3-15(2)27(21(29)17-7-5-4-6-8-17)14-13-19(28)24-22-26-25-20(30-22)16-9-11-18(23)12-10-16/h4-12,15H,3,13-14H2,1-2H3,(H,24,26,28)