2-[(4-cyclopentylsulfanylphenyl)amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(4-cyclopentylsulfanylphenyl)amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-(4-cyclopentylsulfanylanilino)-3-nitro-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[4-(cyclopentylthio)anilino]-3-nitro-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-(4-cyclopentylsulfanylanilino)-3-nitropyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[4-(cyclopentylthio)anilino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=C(C=C2)NC3=C(C(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)SC2=CC=C(C=C2)NC3=C(C(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O3S/c24-19-17(23(25)26)18(21-16-7-3-4-12-22(16)19)20-13-8-10-15(11-9-13)27-14-5-1-2-6-14/h3-4,7-12,14,20H,1-2,5-6H2