4-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]quinazoline

Systemtic Name: 4-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]quinazoline Openeye Name: 4-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]quinazoline CAS Name: 4-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]quinazoline IUPAC Name: 4-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]quinazoline Traditional Name: 4-(4-mesitylsulfonylpiperazino)quinazoline Formula: C21H24N4O2S MolecularWeight: 396.50586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C3=NC=NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C3=NC=NC4=CC=CC=C43)C

InChI

InChI=1S/C21H24N4O2S/c1-15-12-16(2)20(17(3)13-15)28(26,27)25-10-8-24(9-11-25)21-18-6-4-5-7-19(18)22-14-23-21/h4-7,12-14H,8-11H2,1-3H3