3-(4-methoxyphenyl)sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 3-(4-methoxyphenyl)sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: 3-(4-methoxyphenyl)sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide CAS Name: 3-(4-methoxyphenyl)sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide IUPAC Name: 3-(4-methoxyphenyl)sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: 3-(4-methoxyphenyl)sulfonyl-N-(3-propargyl-1,3-benzothiazol-2-ylidene)propionamide Formula: C20H18N2O4S2 MolecularWeight: 414.49792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=CC=CC=C3S2)CC#C

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=CC=CC=C3S2)CC#C

InChI

InChI=1S/C20H18N2O4S2/c1-3-13-22-17-6-4-5-7-18(17)27-20(22)21-19(23)12-14-28(24,25)16-10-8-15(26-2)9-11-16/h1,4-11H,12-14H2,2H3