N-[(4-chloranyl-2-methyl-phenyl)methyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide

Systemtic Name: N-[(4-chloranyl-2-methyl-phenyl)methyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Openeye Name: N-[(4-chloro-2-methyl-phenyl)methyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide CAS Name: N-[(4-chloro-2-methylphenyl)methyl]-5-[2-(methylamino)-4-pyrimidinyl]-2-thiophenecarboxamide IUPAC Name: N-[(4-chloro-2-methylphenyl)methyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Traditional Name: N-(4-chloro-2-methyl-benzyl)-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Formula: C18H17ClN4OS MolecularWeight: 372.87178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)CNC(=O)C2=CC=C(S2)C3=NC(=NC=C3)NC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)CNC(=O)C2=CC=C(S2)C3=NC(=NC=C3)NC

InChI

InChI=1S/C18H17ClN4OS/c1-11-9-13(19)4-3-12(11)10-22-17(24)16-6-5-15(25-16)14-7-8-21-18(20-2)23-14/h3-9H,10H2,1-2H3,(H,22,24)(H,20,21,23)