3-[2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-[2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl]-6-nitro-quinazolin-4-one Openeye Name: 3-[2-(5-methyl-2-thienyl)-2-oxo-ethyl]-6-nitro-quinazolin-4-one CAS Name: 3-[2-(5-methyl-2-thiophenyl)-2-oxoethyl]-6-nitro-4-quinazolinone IUPAC Name: 3-[2-(5-methylthiophen-2-yl)-2-oxoethyl]-6-nitroquinazolin-4-one Traditional Name: 3-[2-keto-2-(5-methyl-2-thienyl)ethyl]-6-nitro-quinazolin-4-one Formula: C15H11N3O4S MolecularWeight: 329.33054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O4S/c1-9-2-5-14(23-9)13(19)7-17-8-16-12-4-3-10(18(21)22)6-11(12)15(17)20/h2-6,8H,7H2,1H3