N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)propanamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)propanamide Traditional Name: 3-benzylsulfonyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)propionamide Formula: C24H24N2O4S2 MolecularWeight: 468.58836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CO3)C(=O)CCS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CO3)C(=O)CCS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H24N2O4S2/c1-17-13-21-22(14-18(17)2)31-24(25-21)26(15-20-9-6-11-30-20)23(27)10-12-32(28,29)16-19-7-4-3-5-8-19/h3-9,11,13-14H,10,12,15-16H2,1-2H3