2,4-dimethylbenzenesulfonic acid; 4-phenyl-1,3-thiazol-2-amine

Systemtic Name: 2,4-dimethylbenzenesulfonic acid; 4-phenyl-1,3-thiazol-2-amine Openeye Name: 2,4-dimethylbenzenesulfonic acid; 4-phenylthiazol-2-amine CAS Name: 2,4-dimethylbenzenesulfonic acid; 4-phenyl-2-thiazolamine IUPAC Name: 2,4-dimethylbenzenesulfonic acid; 4-phenyl-1,3-thiazol-2-amine Traditional Name: 2,4-dimethylbesylic acid; (4-phenylthiazol-2-yl)amine Formula: C17H18N2O3S2 MolecularWeight: 362.46642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)C.C1=CC=C(C=C1)C2=CSC(=N2)N

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)C.C1=CC=C(C=C1)C2=CSC(=N2)N

InChI

InChI=1S/C9H8N2S.C8H10O3S/c10-9-11-8(6-12-9)7-4-2-1-3-5-7;1-6-3-4-8(7(2)5-6)12(9,10)11/h1-6H,(H2,10,11);3-5H,1-2H3,(H,9,10,11)