[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-(4-mesyl-2,3-dihydro-1,4-benzoxazin-2-yl)methanone Formula: C21H24ClN3O4S MolecularWeight: 449.95096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)C

InChI

InChI=1S/C21H24ClN3O4S/c1-15-7-8-16(22)13-18(15)23-9-11-24(12-10-23)21(26)20-14-25(30(2,27)28)17-5-3-4-6-19(17)29-20/h3-8,13,20H,9-12,14H2,1-2H3