3-[2-[1-(4-bromophenyl)imidazol-2-yl]sulfanylethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 3-[2-[1-(4-bromophenyl)imidazol-2-yl]sulfanylethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 3-[[2-[1-(4-bromophenyl)imidazol-2-yl]sulfanylacetyl]amino]-N-cyclopropyl-benzamide CAS Name: 3-[[2-[[1-(4-bromophenyl)-2-imidazolyl]thio]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[[2-[1-(4-bromophenyl)imidazol-2-yl]sulfanylacetyl]amino]-N-cyclopropylbenzamide Traditional Name: 3-[[2-[[1-(4-bromophenyl)imidazol-2-yl]thio]acetyl]amino]-N-cyclopropyl-benzamide Formula: C21H19BrN4O2S MolecularWeight: 471.37016

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CSC3=NC=CN3C4=CC=C(C=C4)Br

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CSC3=NC=CN3C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN4O2S/c22-15-4-8-18(9-5-15)26-11-10-23-21(26)29-13-19(27)24-17-3-1-2-14(12-17)20(28)25-16-6-7-16/h1-5,8-12,16H,6-7,13H2,(H,24,27)(H,25,28)