N-[1-azanyl-3-(4-chlorophenyl)propan-2-yl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-azanyl-3-(4-chlorophenyl)propan-2-yl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Openeye Name: N-[1-(aminomethyl)-2-(4-chlorophenyl)ethyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide CAS Name: N-[1-amino-3-(4-chlorophenyl)propan-2-yl]-5-[2-(methylamino)-4-pyrimidinyl]-2-thiophenecarboxamide IUPAC Name: N-[1-amino-3-(4-chlorophenyl)propan-2-yl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Traditional Name: N-[1-(aminomethyl)-2-(4-chlorophenyl)ethyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Formula: C19H20ClN5OS MolecularWeight: 401.913

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=CC(=N1)C2=CC=C(S2)C(=O)NC(CC3=CC=C(C=C3)Cl)CN

Isomeric SMILES

CNC1=NC=CC(=N1)C2=CC=C(S2)C(=O)NC(CC3=CC=C(C=C3)Cl)CN

InChI

InChI=1S/C19H20ClN5OS/c1-22-19-23-9-8-15(25-19)16-6-7-17(27-16)18(26)24-14(11-21)10-12-2-4-13(20)5-3-12/h2-9,14H,10-11,21H2,1H3,(H,24,26)(H,22,23,25)