3-(2-azanylethylsulfanyl)-5-chloranyl-1,2-benzoxazole-4-carbonitrile

Systemtic Name: 3-(2-azanylethylsulfanyl)-5-chloranyl-1,2-benzoxazole-4-carbonitrile Openeye Name: 3-(2-aminoethylsulfanyl)-5-chloro-1,2-benzoxazole-4-carbonitrile CAS Name: 3-(2-aminoethylthio)-5-chloro-1,2-benzoxazole-4-carbonitrile IUPAC Name: 3-(2-aminoethylsulfanyl)-5-chloro-1,2-benzoxazole-4-carbonitrile Traditional Name: 3-(2-aminoethylthio)-5-chloro-indoxazene-4-carbonitrile Formula: C10H8ClN3OS MolecularWeight: 253.70802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1ON=C2SCCN)C#N)Cl

Isomeric SMILES

C1=CC(=C(C2=C1ON=C2SCCN)C#N)Cl

InChI

InChI=1S/C10H8ClN3OS/c11-7-1-2-8-9(6(7)5-13)10(14-15-8)16-4-3-12/h1-2H,3-4,12H2