2-(butan-2-ylamino)-N-[(2,4-dichlorophenyl)methyl]-4-(1-phenylcyclopentyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(butan-2-ylamino)-N-[(2,4-dichlorophenyl)methyl]-4-(1-phenylcyclopentyl)pyrimidine-5-carboxamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-4-(1-phenylcyclopentyl)-2-(sec-butylamino)pyrimidine-5-carboxamide CAS Name: 2-(butan-2-ylamino)-N-[(2,4-dichlorophenyl)methyl]-4-(1-phenylcyclopentyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(butan-2-ylamino)-N-[(2,4-dichlorophenyl)methyl]-4-(1-phenylcyclopentyl)pyrimidine-5-carboxamide Traditional Name: N-(2,4-dichlorobenzyl)-4-(1-phenylcyclopentyl)-2-(sec-butylamino)pyrimidine-5-carboxamide Formula: C27H30Cl2N4O MolecularWeight: 497.4593

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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)NCC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CCC(C)NC1=NC=C(C(=N1)C2(CCCC2)C3=CC=CC=C3)C(=O)NCC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C27H30Cl2N4O/c1-3-18(2)32-26-31-17-22(25(34)30-16-19-11-12-21(28)15-23(19)29)24(33-26)27(13-7-8-14-27)20-9-5-4-6-10-20/h4-6,9-12,15,17-18H,3,7-8,13-14,16H2,1-2H3,(H,30,34)(H,31,32,33)