4-chloranyl-8-methoxy-2-phenyl-2H-thiochromene-3-carbonitrile

Systemtic Name: 4-chloranyl-8-methoxy-2-phenyl-2H-thiochromene-3-carbonitrile Openeye Name: 4-chloro-8-methoxy-2-phenyl-2H-thiochromene-3-carbonitrile CAS Name: 4-chloro-8-methoxy-2-phenyl-2H-1-benzothiopyran-3-carbonitrile IUPAC Name: 4-chloro-8-methoxy-2-phenyl-2H-thiochromene-3-carbonitrile Traditional Name: 4-chloro-8-methoxy-2-phenyl-2H-thiochromene-3-carbonitrile Formula: C17H12ClNOS MolecularWeight: 313.80128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1SC(C(=C2Cl)C#N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC2=C1SC(C(=C2Cl)C#N)C3=CC=CC=C3

InChI

InChI=1S/C17H12ClNOS/c1-20-14-9-5-8-12-15(18)13(10-19)16(21-17(12)14)11-6-3-2-4-7-11/h2-9,16H,1H3