3-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 3-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: N-(3-allyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)sulfonyl-propanamide CAS Name: 3-(4-methoxyphenyl)sulfonyl-N-[6-(methylthio)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]propanamide IUPAC Name: 3-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: N-[3-allyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]-3-(4-methoxyphenyl)sulfonyl-propionamide Formula: C21H22N2O4S3 MolecularWeight: 462.60538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=C(S2)C=C(C=C3)SC)CC=C

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N=C2N(C3=C(S2)C=C(C=C3)SC)CC=C

InChI

InChI=1S/C21H22N2O4S3/c1-4-12-23-18-10-7-16(28-3)14-19(18)29-21(23)22-20(24)11-13-30(25,26)17-8-5-15(27-2)6-9-17/h4-10,14H,1,11-13H2,2-3H3