N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide Openeye Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide CAS Name: N-cyclopropyl-N-[[4-[(cyclopropylamino)-oxomethyl]phenyl]methyl]-3-(2-pyrimidinylamino)benzamide IUPAC Name: N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-(pyrimidin-2-ylamino)benzamide Traditional Name: N-cyclopropyl-N-[4-(cyclopropylcarbamoyl)benzyl]-3-(2-pyrimidylamino)benzamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC3)C(=O)C4=CC(=CC=C4)NC5=NC=CC=N5

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)CN(C3CC3)C(=O)C4=CC(=CC=C4)NC5=NC=CC=N5

InChI

InChI=1S/C25H25N5O2/c31-23(28-20-9-10-20)18-7-5-17(6-8-18)16-30(22-11-12-22)24(32)19-3-1-4-21(15-19)29-25-26-13-2-14-27-25/h1-8,13-15,20,22H,9-12,16H2,(H,28,31)(H,26,27,29)