2-[5-(1,3-benzothiazol-2-yl)-3-methyl-cyclohexa-1,3-dien-1-yl]ethyl-triethoxy-silane

Systemtic Name: 2-[5-(1,3-benzothiazol-2-yl)-3-methyl-cyclohexa-1,3-dien-1-yl]ethyl-triethoxy-silane Openeye Name: 2-[5-(1,3-benzothiazol-2-yl)-3-methyl-cyclohexa-1,3-dien-1-yl]ethyl-triethoxy-silane CAS Name: 2-[5-(1,3-benzothiazol-2-yl)-3-methyl-1-cyclohexa-1,3-dienyl]ethyl-triethoxysilane IUPAC Name: 2-[5-(1,3-benzothiazol-2-yl)-3-methylcyclohexa-1,3-dien-1-yl]ethyl-triethoxysilane Traditional Name: 2-[5-(1,3-benzothiazol-2-yl)-3-methyl-cyclohexa-1,3-dien-1-yl]ethyl-triethoxy-silane Formula: C22H31NO3SSi MolecularWeight: 417.63694

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Descriptors Computed from Structure

Canonical SMILES:

CCO[Si](CCC1=CC(=CC(C1)C2=NC3=CC=CC=C3S2)C)(OCC)OCC

Isomeric SMILES

CCO[Si](CCC1=CC(=CC(C1)C2=NC3=CC=CC=C3S2)C)(OCC)OCC

InChI

InChI=1S/C22H31NO3SSi/c1-5-24-28(25-6-2,26-7-3)13-12-18-14-17(4)15-19(16-18)22-23-20-10-8-9-11-21(20)27-22/h8-11,14-15,19H,5-7,12-13,16H2,1-4H3