N-[1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylamino]-1-oxidanylidene-propan-2-yl]-4-bromanyl-benzamide

Systemtic Name: N-[1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylamino]-1-oxidanylidene-propan-2-yl]-4-bromanyl-benzamide Openeye Name: N-[2-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylamino]-1-methyl-2-oxo-ethyl]-4-bromo-benzamide CAS Name: N-[1-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methylamino]-1-oxopropan-2-yl]-4-bromobenzamide IUPAC Name: N-[1-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylamino]-1-oxopropan-2-yl]-4-bromobenzamide Traditional Name: N-[2-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylamino]-2-keto-1-methyl-ethyl]-4-bromo-benzamide Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(O1)C2=NC3=CC=CC=C3S2)NC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(C(=O)NCC1=CC=C(O1)C2=NC3=CC=CC=C3S2)NC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H18BrN3O3S/c1-13(25-21(28)14-6-8-15(23)9-7-14)20(27)24-12-16-10-11-18(29-16)22-26-17-4-2-3-5-19(17)30-22/h2-11,13H,12H2,1H3,(H,24,27)(H,25,28)