N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)OC)N2C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)OC)N2C

InChI

InChI=1S/C21H23N3O4S2/c1-14-6-4-8-18-19(14)23(2)21(29-18)22-20(25)17-7-5-13-24(17)30(26,27)16-11-9-15(28-3)10-12-16/h4,6,8-12,17H,5,7,13H2,1-3H3