4-[(4-cyanophenyl)methoxymethyl]-1H-isothiochromene-6-carbonitrile

Systemtic Name: 4-[(4-cyanophenyl)methoxymethyl]-1H-isothiochromene-6-carbonitrile Openeye Name: 4-[(4-cyanophenyl)methoxymethyl]-1H-isothiochromene-6-carbonitrile CAS Name: 4-[(4-cyanophenyl)methoxymethyl]-1H-2-benzothiopyran-6-carbonitrile IUPAC Name: 4-[(4-cyanophenyl)methoxymethyl]-1H-isothiochromene-6-carbonitrile Traditional Name: 4-[(4-cyanobenzyl)oxymethyl]-1H-isothiochromene-6-carbonitrile Formula: C19H14N2OS MolecularWeight: 318.39226

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C#N)C(=CS1)COCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1C2=C(C=C(C=C2)C#N)C(=CS1)COCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H14N2OS/c20-8-14-1-3-15(4-2-14)10-22-11-18-13-23-12-17-6-5-16(9-21)7-19(17)18/h1-7,13H,10-12H2