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

Systemtic Name: 2-[[2-(2-chlorophenyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methylamino]thiophene-3-carbonitrile Openeye Name: 2-[[2-(2-chlorophenyl)-1,3-dioxo-4-isoquinolylidene]methylamino]thiophene-3-carbonitrile CAS Name: 2-[[2-(2-chlorophenyl)-1,3-dioxo-4-isoquinolinylidene]methylamino]-3-thiophenecarbonitrile IUPAC Name: 2-[[2-(2-chlorophenyl)-1,3-dioxoisoquinolin-4-ylidene]methylamino]thiophene-3-carbonitrile Traditional Name: 2-[[2-(2-chlorophenyl)-1,3-diketo-4-isoquinolylidene]methylamino]thiophene-3-carbonitrile Formula: C21H12ClN3O2S MolecularWeight: 405.85688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNC3=C(C=CS3)C#N)C(=O)N(C2=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNC3=C(C=CS3)C#N)C(=O)N(C2=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H12ClN3O2S/c22-17-7-3-4-8-18(17)25-20(26)15-6-2-1-5-14(15)16(21(25)27)12-24-19-13(11-23)9-10-28-19/h1-10,12,24H