N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)-N-(phenylmethyl)prop-2-enamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)-N-(phenylmethyl)prop-2-enamide Openeye Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)prop-2-enamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)-N-(phenylmethyl)-2-propenamide IUPAC Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)prop-2-enamide Traditional Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)acrylamide Formula: C25H21FN2OS MolecularWeight: 416.510443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C=CC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C=CC4=CC=C(C=C4)F)C

InChI

InChI=1S/C25H21FN2OS/c1-17-14-18(2)24-22(15-17)30-25(27-24)28(16-20-6-4-3-5-7-20)23(29)13-10-19-8-11-21(26)12-9-19/h3-15H,16H2,1-2H3