2-(butan-2-ylamino)-N-ethyl-4-(1-phenylcyclopentyl)-N-(phenylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(butan-2-ylamino)-N-ethyl-4-(1-phenylcyclopentyl)-N-(phenylmethyl)pyrimidine-5-carboxamide Openeye Name: N-benzyl-N-ethyl-4-(1-phenylcyclopentyl)-2-(sec-butylamino)pyrimidine-5-carboxamide CAS Name: 2-(butan-2-ylamino)-N-ethyl-4-(1-phenylcyclopentyl)-N-(phenylmethyl)-5-pyrimidinecarboxamide IUPAC Name: N-benzyl-2-(butan-2-ylamino)-N-ethyl-4-(1-phenylcyclopentyl)pyrimidine-5-carboxamide Traditional Name: N-benzyl-N-ethyl-4-(1-phenylcyclopentyl)-2-(sec-butylamino)pyrimidine-5-carboxamide Formula: C29H36N4O MolecularWeight: 456.62234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=C(C(=N1)C2(CCCC2)C3=CC=CC=C3)C(=O)N(CC)CC4=CC=CC=C4

Isomeric SMILES

CCC(C)NC1=NC=C(C(=N1)C2(CCCC2)C3=CC=CC=C3)C(=O)N(CC)CC4=CC=CC=C4

InChI

InChI=1S/C29H36N4O/c1-4-22(3)31-28-30-20-25(27(34)33(5-2)21-23-14-8-6-9-15-23)26(32-28)29(18-12-13-19-29)24-16-10-7-11-17-24/h6-11,14-17,20,22H,4-5,12-13,18-19,21H2,1-3H3,(H,30,31,32)