3-ethylsulfanyl-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 3-ethylsulfanyl-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: N-(3-allyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfanyl-benzamide CAS Name: 3-(ethylthio)-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 3-ethylsulfanyl-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: N-(3-allyl-6-mesyl-1,3-benzothiazol-2-ylidene)-3-(ethylthio)benzamide Formula: C20H20N2O3S3 MolecularWeight: 432.5794

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)CC=C

Isomeric SMILES

CCSC1=CC=CC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)S(=O)(=O)C)CC=C

InChI

InChI=1S/C20H20N2O3S3/c1-4-11-22-17-10-9-16(28(3,24)25)13-18(17)27-20(22)21-19(23)14-7-6-8-15(12-14)26-5-2/h4,6-10,12-13H,1,5,11H2,2-3H3