N-[(2,4-dichlorophenyl)methyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-5-[2-(methylamino)-4-pyrimidinyl]-2-thiophenecarboxamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Traditional Name: N-(2,4-dichlorobenzyl)-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Formula: C17H14Cl2N4OS MolecularWeight: 393.29026

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=CC(=N1)C2=CC=C(S2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CNC1=NC=CC(=N1)C2=CC=C(S2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H14Cl2N4OS/c1-20-17-21-7-6-13(23-17)14-4-5-15(25-14)16(24)22-9-10-2-3-11(18)8-12(10)19/h2-8H,9H2,1H3,(H,22,24)(H,20,21,23)