N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C24H25N3O4S3 MolecularWeight: 515.668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N(CC3=CC=CO3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CS5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N(CC3=CC=CO3)C(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CS5)C

InChI

InChI=1S/C24H25N3O4S3/c1-16-13-17(2)22-20(14-16)25-24(33-22)27(15-19-5-3-11-31-19)23(28)18-7-9-26(10-8-18)34(29,30)21-6-4-12-32-21/h3-6,11-14,18H,7-10,15H2,1-2H3