2-cyclohexyl-5-methyl-4-[4-(phenylsulfonyl)piperazin-1-yl]quinazoline

Systemtic Name: 2-cyclohexyl-5-methyl-4-[4-(phenylsulfonyl)piperazin-1-yl]quinazoline Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2-cyclohexyl-5-methyl-quinazoline CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-2-cyclohexyl-5-methylquinazoline IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-2-cyclohexyl-5-methylquinazoline Traditional Name: 4-(4-besylpiperazino)-2-cyclohexyl-5-methyl-quinazoline Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N=C2N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N=C2N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C25H30N4O2S/c1-19-9-8-14-22-23(19)25(27-24(26-22)20-10-4-2-5-11-20)28-15-17-29(18-16-28)32(30,31)21-12-6-3-7-13-21/h3,6-9,12-14,20H,2,4-5,10-11,15-18H2,1H3