7-[(1-methylsulfonylpiperidin-4-yl)amino]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-[(1-methylsulfonylpiperidin-4-yl)amino]-6-nitro-1H-quinazolin-4-one Openeye Name: 7-[(1-methylsulfonyl-4-piperidyl)amino]-6-nitro-1H-quinazolin-4-one CAS Name: 7-[(1-methylsulfonyl-4-piperidinyl)amino]-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-[(1-methylsulfonylpiperidin-4-yl)amino]-6-nitro-1H-quinazolin-4-one Traditional Name: 7-[(1-mesyl-4-piperidyl)amino]-6-nitro-1H-quinazolin-4-one Formula: C14H17N5O5S MolecularWeight: 367.38028

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC2=C(C=C3C(=C2)NC=NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O5S/c1-25(23,24)18-4-2-9(3-5-18)17-12-7-11-10(6-13(12)19(21)22)14(20)16-8-15-11/h6-9,17H,2-5H2,1H3,(H,15,16,20)