N-(3-morpholin-4-ylpropyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(3-morpholinopropyl)-2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-2-[[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-(3-morpholin-4-ylpropyl)-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-(3-morpholinopropyl)-2-[[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C25H27N7O2S2 MolecularWeight: 521.65758

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

C1COCCN1CCCNC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C25H27N7O2S2/c33-24(27-9-4-12-31-13-15-34-16-14-31)21-17-35-22(28-21)18-36-25-30-29-23(19-7-10-26-11-8-19)32(25)20-5-2-1-3-6-20/h1-3,5-8,10-11,17H,4,9,12-16,18H2,(H,27,33)