N-(4-methoxy-3,7-dimethyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-methoxy-3,7-dimethyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-methoxy-3,7-dimethyl-1,3-benzothiazol-2-ylidene)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-methoxy-3,7-dimethyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(4-methoxy-3,7-dimethyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-(4-methoxy-3,7-dimethyl-1,3-benzothiazol-2-ylidene)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C19H21N3O4S3 MolecularWeight: 451.58274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)N(C(=NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4)S2)C

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)N(C(=NC(=O)C3CCCN3S(=O)(=O)C4=CC=CS4)S2)C

InChI

InChI=1S/C19H21N3O4S3/c1-12-8-9-14(26-3)16-17(12)28-19(21(16)2)20-18(23)13-6-4-10-22(13)29(24,25)15-7-5-11-27-15/h5,7-9,11,13H,4,6,10H2,1-3H3