N-[2-[4-(3,3-dimethylbut-1-ynyl)-1-methyl-pyrazol-3-yl]-4-nitro-phenyl]-5-methyl-1,3-thiazol-2-amine

Systemtic Name: N-[2-[4-(3,3-dimethylbut-1-ynyl)-1-methyl-pyrazol-3-yl]-4-nitro-phenyl]-5-methyl-1,3-thiazol-2-amine Openeye Name: N-[2-[4-(3,3-dimethylbut-1-ynyl)-1-methyl-pyrazol-3-yl]-4-nitro-phenyl]-5-methyl-thiazol-2-amine CAS Name: N-[2-[4-(3,3-dimethylbut-1-ynyl)-1-methyl-3-pyrazolyl]-4-nitrophenyl]-5-methyl-2-thiazolamine IUPAC Name: N-[2-[4-(3,3-dimethylbut-1-ynyl)-1-methylpyrazol-3-yl]-4-nitrophenyl]-5-methyl-1,3-thiazol-2-amine Traditional Name: [2-[4-(3,3-dimethylbut-1-ynyl)-1-methyl-pyrazol-3-yl]-4-nitro-phenyl]-(5-methylthiazol-2-yl)amine Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)NC2=C(C=C(C=C2)[N+](=O)[O-])C3=NN(C=C3C#CC(C)(C)C)C

Isomeric SMILES

CC1=CN=C(S1)NC2=C(C=C(C=C2)[N+](=O)[O-])C3=NN(C=C3C#CC(C)(C)C)C

InChI

InChI=1S/C20H21N5O2S/c1-13-11-21-19(28-13)22-17-7-6-15(25(26)27)10-16(17)18-14(12-24(5)23-18)8-9-20(2,3)4/h6-7,10-12H,1-5H3,(H,21,22)