N-[4-[2-(pyrimidin-2-ylamino)ethyl]phenyl]thiophene-2-carboxamide dihydrochloride

Systemtic Name: N-[4-[2-(pyrimidin-2-ylamino)ethyl]phenyl]thiophene-2-carboxamide dihydrochloride Openeye Name: N-[4-[2-(pyrimidin-2-ylamino)ethyl]phenyl]thiophene-2-carboxamide dihydrochloride CAS Name: N-[4-[2-(2-pyrimidinylamino)ethyl]phenyl]-2-thiophenecarboxamide dihydrochloride IUPAC Name: N-[4-[2-(pyrimidin-2-ylamino)ethyl]phenyl]thiophene-2-carboxamide dihydrochloride Traditional Name: N-[4-[2-(2-pyrimidylamino)ethyl]phenyl]thiophene-2-carboxamide dihydrochloride Formula: C17H18Cl2N4OS MolecularWeight: 397.32202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NCCC2=CC=C(C=C2)NC(=O)C3=CC=CS3.Cl.Cl

Isomeric SMILES

C1=CN=C(N=C1)NCCC2=CC=C(C=C2)NC(=O)C3=CC=CS3.Cl.Cl

InChI

InChI=1S/C17H16N4OS.2ClH/c22-16(15-3-1-12-23-15)21-14-6-4-13(5-7-14)8-11-20-17-18-9-2-10-19-17;;/h1-7,9-10,12H,8,11H2,(H,21,22)(H,18,19,20);2*1H