2-(3-bromophenyl)sulfanyl-6,7-dimethoxy-quinoline-3-carbonitrile

Systemtic Name: 2-(3-bromophenyl)sulfanyl-6,7-dimethoxy-quinoline-3-carbonitrile Openeye Name: 2-(3-bromophenyl)sulfanyl-6,7-dimethoxy-quinoline-3-carbonitrile CAS Name: 2-[(3-bromophenyl)thio]-6,7-dimethoxy-3-quinolinecarbonitrile IUPAC Name: 2-(3-bromophenyl)sulfanyl-6,7-dimethoxyquinoline-3-carbonitrile Traditional Name: 2-[(3-bromophenyl)thio]-6,7-dimethoxy-quinoline-3-carbonitrile Formula: C18H13BrN2O2S MolecularWeight: 401.27702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=N2)SC3=CC(=CC=C3)Br)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=N2)SC3=CC(=CC=C3)Br)C#N)OC

InChI

InChI=1S/C18H13BrN2O2S/c1-22-16-7-11-6-12(10-20)18(21-15(11)9-17(16)23-2)24-14-5-3-4-13(19)8-14/h3-9H,1-2H3