(E)-3-[5-(2-chlorophenyl)thiophen-2-yl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[5-(2-chlorophenyl)thiophen-2-yl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[5-(2-chlorophenyl)-2-thienyl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-[5-(2-chlorophenyl)-2-thiophenyl]-2-(4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-[5-(2-chlorophenyl)thiophen-2-yl]-2-(4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[5-(2-chlorophenyl)-2-thienyl]-2-(4-keto-1H-quinazolin-2-yl)acrylonitrile Formula: C21H12ClN3OS MolecularWeight: 389.85748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=CC3=CC=C(S3)C4=CC=CC=C4Cl)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)/C(=C/C3=CC=C(S3)C4=CC=CC=C4Cl)/C#N

InChI

InChI=1S/C21H12ClN3OS/c22-17-7-3-1-5-15(17)19-10-9-14(27-19)11-13(12-23)20-24-18-8-4-2-6-16(18)21(26)25-20/h1-11H,(H,24,25,26)/b13-11+