N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-(methylsulfinylmethyl)benzamide

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-(methylsulfinylmethyl)benzamide Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-3-(methylsulfinylmethyl)benzamide CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-3-(methylsulfinylmethyl)benzamide IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-(methylsulfinylmethyl)benzamide Traditional Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-3-(methylsulfinylmethyl)benzamide Formula: C21H18N2O3S2 MolecularWeight: 410.50922

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=CC=CC(=C1)C(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)CC1=CC=CC(=C1)C(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18N2O3S2/c1-28(25)13-14-5-4-6-15(11-14)20(24)22-12-16-9-10-18(26-16)21-23-17-7-2-3-8-19(17)27-21/h2-11H,12-13H2,1H3,(H,22,24)