N-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(2-furfuryl)-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C25H25N3O5S2 MolecularWeight: 511.6131

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3=CC=CO3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3=CC=CO3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H25N3O5S2/c1-32-19-8-10-21(11-9-19)35(30,31)27-14-12-18(13-15-27)24(29)28(17-20-5-4-16-33-20)25-26-22-6-2-3-7-23(22)34-25/h2-11,16,18H,12-15,17H2,1H3