3-(4-methylphenyl)sulfonyl-N-(3,4,7-trimethyl-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 3-(4-methylphenyl)sulfonyl-N-(3,4,7-trimethyl-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: 3-(p-tolylsulfonyl)-N-(3,4,7-trimethyl-1,3-benzothiazol-2-ylidene)propanamide CAS Name: 3-(4-methylphenyl)sulfonyl-N-(3,4,7-trimethyl-1,3-benzothiazol-2-ylidene)propanamide IUPAC Name: 3-(4-methylphenyl)sulfonyl-N-(3,4,7-trimethyl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: 3-tosyl-N-(3,4,7-trimethyl-1,3-benzothiazol-2-ylidene)propionamide Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=C(C=CC(=C3S2)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=C(C=CC(=C3S2)C)C)C

InChI

InChI=1S/C20H22N2O3S2/c1-13-5-9-16(10-6-13)27(24,25)12-11-17(23)21-20-22(4)18-14(2)7-8-15(3)19(18)26-20/h5-10H,11-12H2,1-4H3