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

Systemtic Name: N-(furan-2-ylmethyl)-N-(5-methoxy-1,3-benzothiazol-2-yl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-(2-furylmethyl)-N-(5-methoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: N-(2-furanylmethyl)-N-(5-methoxy-1,3-benzothiazol-2-yl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-(furan-2-ylmethyl)-N-(5-methoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-benzylsulfonyl-N-(2-furfuryl)-N-(5-methoxy-1,3-benzothiazol-2-yl)propionamide Formula: C23H22N2O5S2 MolecularWeight: 470.56118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)N(CC3=CC=CO3)C(=O)CCS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)N(CC3=CC=CO3)C(=O)CCS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O5S2/c1-29-18-9-10-21-20(14-18)24-23(31-21)25(15-19-8-5-12-30-19)22(26)11-13-32(27,28)16-17-6-3-2-4-7-17/h2-10,12,14H,11,13,15-16H2,1H3