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

Systemtic Name: N-cyclopropyl-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-cyclopropyl-2-[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-cyclopropyl-2-[[[4-phenyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-cyclopropyl-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-cyclopropyl-2-[[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C21H18N6OS2 MolecularWeight: 434.53722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

C1CC1NC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C21H18N6OS2/c28-20(23-15-8-9-15)17-12-29-18(24-17)13-30-21-26-25-19(14-5-4-10-22-11-14)27(21)16-6-2-1-3-7-16/h1-7,10-12,15H,8-9,13H2,(H,23,28)