2-[(4-azanyl-6-nitro-2-oxidanylidene-1H-quinolin-3-yl)sulfanyl]-3-propyl-quinazolin-4-one

Systemtic Name: 2-[(4-azanyl-6-nitro-2-oxidanylidene-1H-quinolin-3-yl)sulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 2-[(4-amino-6-nitro-2-oxo-1H-quinolin-3-yl)sulfanyl]-3-propyl-quinazolin-4-one CAS Name: 2-[(4-amino-6-nitro-2-oxo-1H-quinolin-3-yl)thio]-3-propyl-4-quinazolinone IUPAC Name: 2-[(4-amino-6-nitro-2-oxo-1H-quinolin-3-yl)sulfanyl]-3-propylquinazolin-4-one Traditional Name: 2-[(4-amino-2-keto-6-nitro-1H-quinolin-3-yl)thio]-3-propyl-quinazolin-4-one Formula: C20H17N5O4S MolecularWeight: 423.44508

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)N

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)N

InChI

InChI=1S/C20H17N5O4S/c1-2-9-24-19(27)12-5-3-4-6-14(12)23-20(24)30-17-16(21)13-10-11(25(28)29)7-8-15(13)22-18(17)26/h3-8,10H,2,9H2,1H3,(H3,21,22,26)