2-azanyl-6-(3,4,5-trimethoxyphenyl)sulfanyl-benzenecarbonitrile

Systemtic Name: 2-azanyl-6-(3,4,5-trimethoxyphenyl)sulfanyl-benzenecarbonitrile Openeye Name: 2-amino-6-(3,4,5-trimethoxyphenyl)sulfanyl-benzonitrile CAS Name: 2-amino-6-[(3,4,5-trimethoxyphenyl)thio]benzonitrile IUPAC Name: 2-amino-6-(3,4,5-trimethoxyphenyl)sulfanylbenzonitrile Traditional Name: 2-amino-6-[(3,4,5-trimethoxyphenyl)thio]benzonitrile Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)SC2=CC=CC(=C2C#N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)SC2=CC=CC(=C2C#N)N

InChI

InChI=1S/C16H16N2O3S/c1-19-13-7-10(8-14(20-2)16(13)21-3)22-15-6-4-5-12(18)11(15)9-17/h4-8H,18H2,1-3H3