5-[2-[[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino]ethylamino]thiophene-2-carbonitrile

Systemtic Name: 5-[2-[[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino]ethylamino]thiophene-2-carbonitrile Openeye Name: 5-[2-[[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino]ethylamino]thiophene-2-carbonitrile CAS Name: 5-[2-[[2-(2,4-dichlorophenyl)-4-quinazolinyl]amino]ethylamino]-2-thiophenecarbonitrile IUPAC Name: 5-[2-[[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino]ethylamino]thiophene-2-carbonitrile Traditional Name: 5-[2-[[2-(2,4-dichlorophenyl)quinazolin-4-yl]amino]ethylamino]thiophene-2-carbonitrile Formula: C21H15Cl2N5S MolecularWeight: 440.3483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=C(C=C(C=C3)Cl)Cl)NCCNC4=CC=C(S4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=C(C=C(C=C3)Cl)Cl)NCCNC4=CC=C(S4)C#N

InChI

InChI=1S/C21H15Cl2N5S/c22-13-5-7-15(17(23)11-13)21-27-18-4-2-1-3-16(18)20(28-21)26-10-9-25-19-8-6-14(12-24)29-19/h1-8,11,25H,9-10H2,(H,26,27,28)