2-[[2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methylamino]thiophene-3-carbonitrile

Systemtic Name: 2-[[2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methylamino]thiophene-3-carbonitrile Openeye Name: 2-[[2-(4-ethoxyphenyl)-1,3-dioxo-4-isoquinolylidene]methylamino]thiophene-3-carbonitrile CAS Name: 2-[[2-(4-ethoxyphenyl)-1,3-dioxo-4-isoquinolinylidene]methylamino]-3-thiophenecarbonitrile IUPAC Name: 2-[[2-(4-ethoxyphenyl)-1,3-dioxoisoquinolin-4-ylidene]methylamino]thiophene-3-carbonitrile Traditional Name: 2-[(1,3-diketo-2-p-phenetyl-4-isoquinolylidene)methylamino]thiophene-3-carbonitrile Formula: C23H17N3O3S MolecularWeight: 415.46438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=C(C=CS4)C#N)C2=O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=C(C=CS4)C#N)C2=O

InChI

InChI=1S/C23H17N3O3S/c1-2-29-17-9-7-16(8-10-17)26-22(27)19-6-4-3-5-18(19)20(23(26)28)14-25-21-15(13-24)11-12-30-21/h3-12,14,25H,2H2,1H3