6-chloranyl-N-[3-[[4-(diethylaminomethyl)phenyl]carbonylamino]-4-methyl-phenyl]pyrimidine-4-carboxamide

Systemtic Name: 6-chloranyl-N-[3-[[4-(diethylaminomethyl)phenyl]carbonylamino]-4-methyl-phenyl]pyrimidine-4-carboxamide Openeye Name: 6-chloro-N-[3-[[4-(diethylaminomethyl)benzoyl]amino]-4-methyl-phenyl]pyrimidine-4-carboxamide CAS Name: 6-chloro-N-[3-[[[4-(diethylaminomethyl)phenyl]-oxomethyl]amino]-4-methylphenyl]-4-pyrimidinecarboxamide IUPAC Name: 6-chloro-N-[3-[[4-(diethylaminomethyl)benzoyl]amino]-4-methylphenyl]pyrimidine-4-carboxamide Traditional Name: 6-chloro-N-[3-[[4-(diethylaminomethyl)benzoyl]amino]-4-methyl-phenyl]pyrimidine-4-carboxamide Formula: C24H26ClN5O2 MolecularWeight: 451.94854

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)C3=CC(=NC=N3)Cl)C

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)NC(=O)C3=CC(=NC=N3)Cl)C

InChI

InChI=1S/C24H26ClN5O2/c1-4-30(5-2)14-17-7-9-18(10-8-17)23(31)29-20-12-19(11-6-16(20)3)28-24(32)21-13-22(25)27-15-26-21/h6-13,15H,4-5,14H2,1-3H3,(H,28,32)(H,29,31)