N'-[4-[4-(2-phenylazanylphenyl)carbonylpiperazin-1-yl]phenyl]thiophene-2-carboximidamide dihydrochloride

Systemtic Name: N'-[4-[4-(2-phenylazanylphenyl)carbonylpiperazin-1-yl]phenyl]thiophene-2-carboximidamide dihydrochloride Openeye Name: N'-[4-[4-(2-anilinobenzoyl)piperazin-1-yl]phenyl]thiophene-2-carboxamidine dihydrochloride CAS Name: N'-[4-[4-[(2-anilinophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-thiophenecarboximidamide dihydrochloride IUPAC Name: N'-[4-[4-(2-anilinobenzoyl)piperazin-1-yl]phenyl]thiophene-2-carboximidamide dihydrochloride Traditional Name: N'-[4-[4-(2-anilinobenzoyl)piperazino]phenyl]thiophene-2-carboxamidine dihydrochloride Formula: C28H29Cl2N5OS MolecularWeight: 554.53376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)N=C(C3=CC=CS3)N)C(=O)C4=CC=CC=C4NC5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)N=C(C3=CC=CS3)N)C(=O)C4=CC=CC=C4NC5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C28H27N5OS.2ClH/c29-27(26-11-6-20-35-26)31-22-12-14-23(15-13-22)32-16-18-33(19-17-32)28(34)24-9-4-5-10-25(24)30-21-7-2-1-3-8-21;;/h1-15,20,30H,16-19H2,(H2,29,31);2*1H