N-[3-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]amino]-3-oxidanylidene-propyl]-4-bromanyl-benzamide

Systemtic Name: N-[3-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]amino]-3-oxidanylidene-propyl]-4-bromanyl-benzamide Openeye Name: N-[3-[[4-(4-acetamidophenyl)thiazol-2-yl]amino]-3-oxo-propyl]-4-bromo-benzamide CAS Name: N-[3-[[4-(4-acetamidophenyl)-2-thiazolyl]amino]-3-oxopropyl]-4-bromobenzamide IUPAC Name: N-[3-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]amino]-3-oxopropyl]-4-bromobenzamide Traditional Name: N-[3-[[4-(4-acetamidophenyl)thiazol-2-yl]amino]-3-keto-propyl]-4-bromo-benzamide Formula: C21H19BrN4O3S MolecularWeight: 487.36956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H19BrN4O3S/c1-13(27)24-17-8-4-14(5-9-17)18-12-30-21(25-18)26-19(28)10-11-23-20(29)15-2-6-16(22)7-3-15/h2-9,12H,10-11H2,1H3,(H,23,29)(H,24,27)(H,25,26,28)