4-chloranyl-1,2-dimethyl-benzene; 2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-phenylazanyl-1,3-thiazol-3-ium-5-yl]ethanamide

Systemtic Name: 4-chloranyl-1,2-dimethyl-benzene; 2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-phenylazanyl-1,3-thiazol-3-ium-5-yl]ethanamide Openeye Name: 2-[2-anilino-4-oxo-3-(tetrahydrofuran-2-ylmethyl)thiazol-3-ium-5-yl]acetamide; 4-chloro-1,2-dimethyl-benzene CAS Name: 2-[2-anilino-4-oxo-3-(2-oxolanylmethyl)-5-thiazol-3-iumyl]acetamide; 4-chloro-1,2-dimethylbenzene IUPAC Name: 2-[2-anilino-4-oxo-3-(oxolan-2-ylmethyl)-1,3-thiazol-3-ium-5-yl]acetamide; 4-chloro-1,2-dimethylbenzene Traditional Name: 2-[2-anilino-4-keto-3-(tetrahydrofurfuryl)-2-thiazolin-3-ium-5-yl]acetamide; 4-chloro-1,2-dimethyl-benzene Formula: C24H29ClN3O3S+ MolecularWeight: 475.02336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)C.C1CC(OC1)C[N+]2=C(SC(C2=O)CC(=O)N)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)C.C1CC(OC1)C[N+]2=C(SC(C2=O)CC(=O)N)NC3=CC=CC=C3

InChI

InChI=1S/C16H19N3O3S.C8H9Cl/c17-14(20)9-13-15(21)19(10-12-7-4-8-22-12)16(23-13)18-11-5-2-1-3-6-11;1-6-3-4-8(9)5-7(6)2/h1-3,5-6,12-13H,4,7-10H2,(H2,17,20);3-5H,1-2H3/p+1