4-(2-chloranyl-4-methoxy-5-methyl-phenyl)-N-[1-(2-cyclopropylphenyl)but-3-yn-2-yl]-5-methyl-1,3-thiazol-2-amine

Systemtic Name: 4-(2-chloranyl-4-methoxy-5-methyl-phenyl)-N-[1-(2-cyclopropylphenyl)but-3-yn-2-yl]-5-methyl-1,3-thiazol-2-amine Openeye Name: 4-(2-chloro-4-methoxy-5-methyl-phenyl)-N-[1-[(2-cyclopropylphenyl)methyl]prop-2-ynyl]-5-methyl-thiazol-2-amine CAS Name: 4-(2-chloro-4-methoxy-5-methylphenyl)-N-[1-(2-cyclopropylphenyl)but-3-yn-2-yl]-5-methyl-2-thiazolamine IUPAC Name: 4-(2-chloro-4-methoxy-5-methylphenyl)-N-[1-(2-cyclopropylphenyl)but-3-yn-2-yl]-5-methyl-1,3-thiazol-2-amine Traditional Name: [4-(2-chloro-4-methoxy-5-methyl-phenyl)-5-methyl-thiazol-2-yl]-[1-(2-cyclopropylbenzyl)prop-2-ynyl]amine Formula: C25H25ClN2OS MolecularWeight: 436.9968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2=C(SC(=N2)NC(CC3=CC=CC=C3C4CC4)C#C)C)Cl)OC

Isomeric SMILES

CC1=C(C=C(C(=C1)C2=C(SC(=N2)NC(CC3=CC=CC=C3C4CC4)C#C)C)Cl)OC

InChI

InChI=1S/C25H25ClN2OS/c1-5-19(13-18-8-6-7-9-20(18)17-10-11-17)27-25-28-24(16(3)30-25)21-12-15(2)23(29-4)14-22(21)26/h1,6-9,12,14,17,19H,10-11,13H2,2-4H3,(H,27,28)