N-(furan-2-ylmethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(2-furylmethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(2-furanylmethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(2-furfuryl)-N-(4-methyl-1,3-benzothiazol-2-yl)-1-(2-thienylsulfonyl)pipecolinamide Formula: C23H23N3O4S3 MolecularWeight: 501.64142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CO3)C(=O)C4CCCCN4S(=O)(=O)C5=CC=CS5

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CO3)C(=O)C4CCCCN4S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C23H23N3O4S3/c1-16-7-4-10-19-21(16)24-23(32-19)25(15-17-8-5-13-30-17)22(27)18-9-2-3-12-26(18)33(28,29)20-11-6-14-31-20/h4-8,10-11,13-14,18H,2-3,9,12,15H2,1H3