N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)cyclohex-3-ene-1-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)cyclohex-3-ene-1-carboxamide Openeye Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)cyclohex-3-ene-1-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1-cyclohex-3-enecarboxamide IUPAC Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)cyclohex-3-ene-1-carboxamide Traditional Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)cyclohex-3-ene-1-carboxamide Formula: C23H24N2OS MolecularWeight: 376.51446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCC=CC4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCC=CC4)C

InChI

InChI=1S/C23H24N2OS/c1-16-13-17(2)21-20(14-16)27-23(24-21)25(15-18-9-5-3-6-10-18)22(26)19-11-7-4-8-12-19/h3-7,9-10,13-14,19H,8,11-12,15H2,1-2H3