7-chloranyl-2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[4-(4-methoxyphenyl)sulfonylpiperazino]methyl]-1H-quinazolin-4-one Formula: C20H21ClN4O4S MolecularWeight: 448.92314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4O4S/c1-29-15-3-5-16(6-4-15)30(27,28)25-10-8-24(9-11-25)13-19-22-18-12-14(21)2-7-17(18)20(26)23-19/h2-7,12H,8-11,13H2,1H3,(H,22,23,26)