N-[5-cyclopropyl-4-(3-fluoranyl-4-methyl-phenyl)pent-1-yn-3-yl]-4-(4-methoxy-2,5-dimethyl-phenyl)-5-methyl-1,3-thiazol-2-amine

Systemtic Name: N-[5-cyclopropyl-4-(3-fluoranyl-4-methyl-phenyl)pent-1-yn-3-yl]-4-(4-methoxy-2,5-dimethyl-phenyl)-5-methyl-1,3-thiazol-2-amine Openeye Name: N-[1-[2-cyclopropyl-1-(3-fluoro-4-methyl-phenyl)ethyl]prop-2-ynyl]-4-(4-methoxy-2,5-dimethyl-phenyl)-5-methyl-thiazol-2-amine CAS Name: N-[5-cyclopropyl-4-(3-fluoro-4-methylphenyl)pent-1-yn-3-yl]-4-(4-methoxy-2,5-dimethylphenyl)-5-methyl-2-thiazolamine IUPAC Name: N-[5-cyclopropyl-4-(3-fluoro-4-methylphenyl)pent-1-yn-3-yl]-4-(4-methoxy-2,5-dimethylphenyl)-5-methyl-1,3-thiazol-2-amine Traditional Name: 1-[2-cyclopropyl-1-(3-fluoro-4-methyl-phenyl)ethyl]prop-2-ynyl-[4-(4-methoxy-2,5-dimethyl-phenyl)-5-methyl-thiazol-2-yl]amine Formula: C28H31FN2OS MolecularWeight: 462.621943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CC2CC2)C(C#C)NC3=NC(=C(S3)C)C4=CC(=C(C=C4C)OC)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(CC2CC2)C(C#C)NC3=NC(=C(S3)C)C4=CC(=C(C=C4C)OC)C)F

InChI

InChI=1S/C28H31FN2OS/c1-7-25(23(14-20-9-10-20)21-11-8-16(2)24(29)15-21)30-28-31-27(19(5)33-28)22-12-18(4)26(32-6)13-17(22)3/h1,8,11-13,15,20,23,25H,9-10,14H2,2-6H3,(H,30,31)