N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-N-(oxolan-2-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-N-(oxolan-2-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-N-(tetrahydrofuran-2-ylmethyl)pyrrolidine-2-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-N-(2-oxolanylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-N-(oxolan-2-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-(4-methoxyphenyl)sulfonyl-N-(tetrahydrofurfuryl)pyrrolidine-2-carboxamide Formula: C26H31N3O5S2 MolecularWeight: 529.67144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3CCCO3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(C=C5)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3CCCO3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(C=C5)OC)C

InChI

InChI=1S/C26H31N3O5S2/c1-17-14-18(2)24-23(15-17)35-26(27-24)28(16-20-6-5-13-34-20)25(30)22-7-4-12-29(22)36(31,32)21-10-8-19(33-3)9-11-21/h8-11,14-15,20,22H,4-7,12-13,16H2,1-3H3