3-propan-2-ylsulfonyl-N-(3-prop-2-enyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 3-propan-2-ylsulfonyl-N-(3-prop-2-enyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: N-(3-allyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)-3-isopropylsulfonyl-benzamide CAS Name: 3-propan-2-ylsulfonyl-N-(3-prop-2-enyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 3-propan-2-ylsulfonyl-N-(3-prop-2-enyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: N-(3-allyl-6-sulfamoyl-1,3-benzothiazol-2-ylidene)-3-isopropylsulfonyl-benzamide Formula: C20H21N3O5S3 MolecularWeight: 479.59284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)N)CC=C

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)N)CC=C

InChI

InChI=1S/C20H21N3O5S3/c1-4-10-23-17-9-8-16(31(21,27)28)12-18(17)29-20(23)22-19(24)14-6-5-7-15(11-14)30(25,26)13(2)3/h4-9,11-13H,1,10H2,2-3H3,(H2,21,27,28)