N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(phenylsulfonyl)propanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)propanamide CAS Name: 3-(benzenesulfonyl)-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)propanamide Traditional Name: 3-besyl-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furfuryl)propionamide Formula: C21H17BrN2O4S2 MolecularWeight: 505.40468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C21H17BrN2O4S2/c22-15-8-9-18-19(13-15)29-21(23-18)24(14-16-5-4-11-28-16)20(25)10-12-30(26,27)17-6-2-1-3-7-17/h1-9,11,13H,10,12,14H2