N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-phenoxy-benzamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-phenoxy-benzamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-phenoxy-benzamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-phenoxybenzamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-phenoxybenzamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-phenoxy-benzamide Formula: C27H22N2O3S MolecularWeight: 454.54018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CO3)C(=O)C4=CC(=CC=C4)OC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CO3)C(=O)C4=CC(=CC=C4)OC5=CC=CC=C5)C

InChI

InChI=1S/C27H22N2O3S/c1-18-14-19(2)25-24(15-18)33-27(28-25)29(17-23-12-7-13-31-23)26(30)20-8-6-11-22(16-20)32-21-9-4-3-5-10-21/h3-16H,17H2,1-2H3