2-[3-piperazin-1-yl-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]-1,3-benzoxazole-5-carbonitrile dihydrochloride

Systemtic Name: 2-[3-piperazin-1-yl-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]-1,3-benzoxazole-5-carbonitrile dihydrochloride Openeye Name: 2-[3-piperazin-1-yl-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]-1,3-benzoxazole-5-carbonitrile dihydrochloride CAS Name: 2-[5-[oxo(3-thiazolidinyl)methyl]-3-(1-piperazinyl)-3-pyrrolidinyl]-1,3-benzoxazole-5-carbonitrile dihydrochloride IUPAC Name: 2-[3-piperazin-1-yl-5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]-1,3-benzoxazole-5-carbonitrile dihydrochloride Traditional Name: 2-[3-piperazino-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]-1,3-benzoxazole-5-carbonitrile dihydrochloride Formula: C20H26Cl2N6O2S MolecularWeight: 485.43044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2(CC(NC2)C(=O)N3CCSC3)C4=NC5=C(O4)C=CC(=C5)C#N.Cl.Cl

Isomeric SMILES

C1CN(CCN1)C2(CC(NC2)C(=O)N3CCSC3)C4=NC5=C(O4)C=CC(=C5)C#N.Cl.Cl

InChI

InChI=1S/C20H24N6O2S.2ClH/c21-11-14-1-2-17-15(9-14)24-19(28-17)20(26-5-3-22-4-6-26)10-16(23-12-20)18(27)25-7-8-29-13-25;;/h1-2,9,16,22-23H,3-8,10,12-13H2;2*1H