N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-propan-2-ylphenyl)propanamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-propan-2-ylphenyl)propanamide Openeye Name: 3-(4-isopropylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-propan-2-ylphenyl)propanamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-propan-2-ylphenyl)propanamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-3-p-cumenyl-propionamide Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H22N2O3S2/c1-13(2)15-7-4-14(5-8-15)6-11-19(23)22-20-21-17-10-9-16(27(3,24)25)12-18(17)26-20/h4-5,7-10,12-13H,6,11H2,1-3H3,(H,21,22,23)