(E)-2-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-[5-(2-nitrophenyl)thiophen-2-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-[5-(2-nitrophenyl)thiophen-2-yl]prop-2-enenitrile Openeye Name: (E)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)-3-[5-(2-nitrophenyl)-2-thienyl]prop-2-enenitrile CAS Name: (E)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)-3-[5-(2-nitrophenyl)-2-thiophenyl]-2-propenenitrile IUPAC Name: (E)-2-(7-chloro-4-oxo-1H-quinazolin-2-yl)-3-[5-(2-nitrophenyl)thiophen-2-yl]prop-2-enenitrile Traditional Name: (E)-2-(7-chloro-4-keto-1H-quinazolin-2-yl)-3-[5-(2-nitrophenyl)-2-thienyl]acrylonitrile Formula: C21H11ClN4O3S MolecularWeight: 434.85504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(S2)C=C(C#N)C3=NC(=O)C4=C(N3)C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(S2)/C=C(\C#N)/C3=NC(=O)C4=C(N3)C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H11ClN4O3S/c22-13-5-7-15-17(10-13)24-20(25-21(15)27)12(11-23)9-14-6-8-19(30-14)16-3-1-2-4-18(16)26(28)29/h1-10H,(H,24,25,27)/b12-9+