1-[(3-nitrophenyl)methylsulfanyl]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 1-[(3-nitrophenyl)methylsulfanyl]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 1-[(3-nitrophenyl)methylsulfanyl]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 1-[(3-nitrophenyl)methylthio]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 1-[(3-nitrophenyl)methylsulfanyl]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 1-[(3-nitrobenzyl)thio]-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O3S/c1-2-10-22-17(25)15-8-3-4-9-16(15)23-18(22)20-21-19(23)28-12-13-6-5-7-14(11-13)24(26)27/h3-9,11H,2,10,12H2,1H3