2-(3-cyclohexyl-4-oxidanylidene-2-phenylazanyl-1,3-thiazol-3-ium-5-yl)ethanamide; 1,3-dimethylbenzene

Systemtic Name: 2-(3-cyclohexyl-4-oxidanylidene-2-phenylazanyl-1,3-thiazol-3-ium-5-yl)ethanamide; 1,3-dimethylbenzene Openeye Name: 2-(2-anilino-3-cyclohexyl-4-oxo-thiazol-3-ium-5-yl)acetamide; m-xylene CAS Name: 2-(2-anilino-3-cyclohexyl-4-oxo-5-thiazol-3-iumyl)acetamide; 1,3-xylene IUPAC Name: 2-(2-anilino-3-cyclohexyl-4-oxo-1,3-thiazol-3-ium-5-yl)acetamide; 1,3-xylene Traditional Name: 2-(2-anilino-3-cyclohexyl-4-keto-2-thiazolin-3-ium-5-yl)acetamide; m-xylene Formula: C25H32N3O2S+ MolecularWeight: 438.60548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C.C1CCC(CC1)[N+]2=C(SC(C2=O)CC(=O)N)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)C.C1CCC(CC1)[N+]2=C(SC(C2=O)CC(=O)N)NC3=CC=CC=C3

InChI

InChI=1S/C17H21N3O2S.C8H10/c18-15(21)11-14-16(22)20(13-9-5-2-6-10-13)17(23-14)19-12-7-3-1-4-8-12;1-7-4-3-5-8(2)6-7/h1,3-4,7-8,13-14H,2,5-6,9-11H2,(H2,18,21);3-6H,1-2H3/p+1