(2-methyl-4-pyrimidin-5-yl-but-3-yn-2-yl) N-(4-chlorophenyl)carbamate

Systemtic Name: (2-methyl-4-pyrimidin-5-yl-but-3-yn-2-yl) N-(4-chlorophenyl)carbamate Openeye Name: (1,1-dimethyl-3-pyrimidin-5-yl-prop-2-ynyl) N-(4-chlorophenyl)carbamate CAS Name: N-(4-chlorophenyl)carbamic acid [2-methyl-4-(5-pyrimidinyl)but-3-yn-2-yl] ester IUPAC Name: (2-methyl-4-pyrimidin-5-ylbut-3-yn-2-yl) N-(4-chlorophenyl)carbamate Traditional Name: N-(4-chlorophenyl)carbamic acid [1,1-dimethyl-3-(5-pyrimidyl)prop-2-ynyl] ester Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CN=CN=C1)OC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C#CC1=CN=CN=C1)OC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H14ClN3O2/c1-16(2,8-7-12-9-18-11-19-10-12)22-15(21)20-14-5-3-13(17)4-6-14/h3-6,9-11H,1-2H3,(H,20,21)