N-[1-[4-(4-aminocarbonyl-1,2,3-triazol-1-yl)phenyl]ethyl]-5-chloranyl-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide

Systemtic Name: N-[1-[4-(4-aminocarbonyl-1,2,3-triazol-1-yl)phenyl]ethyl]-5-chloranyl-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide Openeye Name: N-[1-[4-(4-carbamoyltriazol-1-yl)phenyl]ethyl]-5-chloro-2-pyrrolidin-1-yl-pyrimidine-4-carboxamide CAS Name: N-[1-[4-(4-carbamoyl-1-triazolyl)phenyl]ethyl]-5-chloro-2-(1-pyrrolidinyl)-4-pyrimidinecarboxamide IUPAC Name: N-[1-[4-(4-carbamoyltriazol-1-yl)phenyl]ethyl]-5-chloro-2-pyrrolidin-1-ylpyrimidine-4-carboxamide Traditional Name: N-[1-[4-(4-carbamoyltriazol-1-yl)phenyl]ethyl]-5-chloro-2-pyrrolidino-pyrimidine-4-carboxamide Formula: C20H21ClN8O2 MolecularWeight: 440.88614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=C(N=N2)C(=O)N)NC(=O)C3=NC(=NC=C3Cl)N4CCCC4

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=C(N=N2)C(=O)N)NC(=O)C3=NC(=NC=C3Cl)N4CCCC4

InChI

InChI=1S/C20H21ClN8O2/c1-12(13-4-6-14(7-5-13)29-11-16(18(22)30)26-27-29)24-19(31)17-15(21)10-23-20(25-17)28-8-2-3-9-28/h4-7,10-12H,2-3,8-9H2,1H3,(H2,22,30)(H,24,31)