N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-tosyl-propionamide Formula: C22H24N2O3S2 MolecularWeight: 428.56756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=C(S2)C=C(C(=C3)C)C)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=C(S2)C=C(C(=C3)C)C)CC=C

InChI

InChI=1S/C22H24N2O3S2/c1-5-11-24-19-13-16(3)17(4)14-20(19)28-22(24)23-21(25)10-12-29(26,27)18-8-6-15(2)7-9-18/h5-9,13-14H,1,10-12H2,2-4H3