4-azanyl-6-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]-N-(2-piperidin-1-ylethyl)pyrimidine-5-carboxamide

Systemtic Name: 4-azanyl-6-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]-N-(2-piperidin-1-ylethyl)pyrimidine-5-carboxamide Openeye Name: 4-amino-6-(4-benzyloxy-3-chloro-anilino)-N-[2-(1-piperidyl)ethyl]pyrimidine-5-carboxamide CAS Name: 4-amino-6-(3-chloro-4-phenylmethoxyanilino)-N-[2-(1-piperidinyl)ethyl]-5-pyrimidinecarboxamide IUPAC Name: 4-amino-6-(3-chloro-4-phenylmethoxyanilino)-N-(2-piperidin-1-ylethyl)pyrimidine-5-carboxamide Traditional Name: 4-amino-6-(4-benzoxy-3-chloro-anilino)-N-(2-piperidinoethyl)pyrimidine-5-carboxamide Formula: C25H29ClN6O2 MolecularWeight: 480.98976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC(=O)C2=C(N=CN=C2NC3=CC(=C(C=C3)OCC4=CC=CC=C4)Cl)N

Isomeric SMILES

C1CCN(CC1)CCNC(=O)C2=C(N=CN=C2NC3=CC(=C(C=C3)OCC4=CC=CC=C4)Cl)N

InChI

InChI=1S/C25H29ClN6O2/c26-20-15-19(9-10-21(20)34-16-18-7-3-1-4-8-18)31-24-22(23(27)29-17-30-24)25(33)28-11-14-32-12-5-2-6-13-32/h1,3-4,7-10,15,17H,2,5-6,11-14,16H2,(H,28,33)(H3,27,29,30,31)