2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-4H-thieno[3,2-h]chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-4H-thieno[3,2-h]chromene-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-4H-thieno[3,2-h]chromene-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-4H-thieno[3,2-h][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-4H-thieno[3,2-h]chromene-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-4H-thieno[3,2-h]chromene-3-carbonitrile Formula: C20H15BrN2O3S MolecularWeight: 443.3137

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C3=C(C4=C(C=C3)C=CS4)OC(=C2C#N)N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C3=C(C4=C(C=C3)C=CS4)OC(=C2C#N)N)Br)OC

InChI

InChI=1S/C20H15BrN2O3S/c1-24-15-8-11(7-14(21)18(15)25-2)16-12-4-3-10-5-6-27-19(10)17(12)26-20(23)13(16)9-22/h3-8,16H,23H2,1-2H3