5-chloranyl-2-pyrrolidin-1-yl-N-[3-(thiophen-2-ylcarbonylamino)phenyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-pyrrolidin-1-yl-N-[3-(thiophen-2-ylcarbonylamino)phenyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-pyrrolidin-1-yl-N-[3-(thiophene-2-carbonylamino)phenyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-2-(1-pyrrolidinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-pyrrolidin-1-yl-N-[3-(thiophene-2-carbonylamino)phenyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-pyrrolidino-N-[3-(2-thenoylamino)phenyl]pyrimidine-4-carboxamide Formula: C20H18ClN5O2S MolecularWeight: 427.90722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=C(C(=N2)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CC=CS4)Cl

Isomeric SMILES

C1CCN(C1)C2=NC=C(C(=N2)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CC=CS4)Cl

InChI

InChI=1S/C20H18ClN5O2S/c21-15-12-22-20(26-8-1-2-9-26)25-17(15)19(28)24-14-6-3-5-13(11-14)23-18(27)16-7-4-10-29-16/h3-7,10-12H,1-2,8-9H2,(H,23,27)(H,24,28)