N-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)amino]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)amino]phenyl]thiophene-2-carboxamide Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)N4CCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)N4CCCC4

InChI

InChI=1S/C20H21N5OS/c1-14-13-18(25-10-2-3-11-25)24-20(21-14)23-16-8-6-15(7-9-16)22-19(26)17-5-4-12-27-17/h4-9,12-13H,2-3,10-11H2,1H3,(H,22,26)(H,21,23,24)