2-(dimethylamino)-1-(2,3-dimethyl-2H-1,3-benzothiazol-5-yl)-2-(phenylmethyl)butan-1-one

Systemtic Name: 2-(dimethylamino)-1-(2,3-dimethyl-2H-1,3-benzothiazol-5-yl)-2-(phenylmethyl)butan-1-one Openeye Name: 2-benzyl-2-(dimethylamino)-1-(2,3-dimethyl-2H-1,3-benzothiazol-5-yl)butan-1-one CAS Name: 2-(dimethylamino)-1-(2,3-dimethyl-2H-1,3-benzothiazol-5-yl)-2-(phenylmethyl)-1-butanone IUPAC Name: 2-benzyl-2-(dimethylamino)-1-(2,3-dimethyl-2H-1,3-benzothiazol-5-yl)butan-1-one Traditional Name: 2-benzyl-2-(dimethylamino)-1-(2,3-dimethyl-2H-1,3-benzothiazol-5-yl)butan-1-one Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)(C(=O)C2=CC3=C(C=C2)SC(N3C)C)N(C)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)(C(=O)C2=CC3=C(C=C2)SC(N3C)C)N(C)C

InChI

InChI=1S/C22H28N2OS/c1-6-22(23(3)4,15-17-10-8-7-9-11-17)21(25)18-12-13-20-19(14-18)24(5)16(2)26-20/h7-14,16H,6,15H2,1-5H3