N-tert-butyl-2-chloranyl-4-(prop-2-ynylamino)pyrimidine-5-carboxamide

Systemtic Name: N-tert-butyl-2-chloranyl-4-(prop-2-ynylamino)pyrimidine-5-carboxamide Openeye Name: N-tert-butyl-2-chloro-4-(prop-2-ynylamino)pyrimidine-5-carboxamide CAS Name: N-tert-butyl-2-chloro-4-(prop-2-ynylamino)-5-pyrimidinecarboxamide IUPAC Name: N-tert-butyl-2-chloro-4-(prop-2-ynylamino)pyrimidine-5-carboxamide Traditional Name: N-tert-butyl-2-chloro-4-(propargylamino)pyrimidine-5-carboxamide Formula: C12H15ClN4O MolecularWeight: 266.7267

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CN=C(N=C1NCC#C)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=CN=C(N=C1NCC#C)Cl

InChI

InChI=1S/C12H15ClN4O/c1-5-6-14-9-8(7-15-11(13)16-9)10(18)17-12(2,3)4/h1,7H,6H2,2-4H3,(H,17,18)(H,14,15,16)