2-[phenyl-[5-phenyl-4-(1,2,4-triazol-1-yl)-1,2-oxazol-3-yl]amino]ethanethiol

Systemtic Name: 2-[phenyl-[5-phenyl-4-(1,2,4-triazol-1-yl)-1,2-oxazol-3-yl]amino]ethanethiol Openeye Name: 2-(N-[5-phenyl-4-(1,2,4-triazol-1-yl)isoxazol-3-yl]anilino)ethanethiol CAS Name: 2-(N-[5-phenyl-4-(1,2,4-triazol-1-yl)-3-isoxazolyl]anilino)ethanethiol IUPAC Name: 2-(N-[5-phenyl-4-(1,2,4-triazol-1-yl)-1,2-oxazol-3-yl]anilino)ethanethiol Traditional Name: 2-(N-[5-phenyl-4-(1,2,4-triazol-1-yl)isoxazol-3-yl]anilino)ethanethiol Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NO2)N(CCS)C3=CC=CC=C3)N4C=NC=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NO2)N(CCS)C3=CC=CC=C3)N4C=NC=N4

InChI

InChI=1S/C19H17N5OS/c26-12-11-23(16-9-5-2-6-10-16)19-17(24-14-20-13-21-24)18(25-22-19)15-7-3-1-4-8-15/h1-10,13-14,26H,11-12H2