6-[[4-[2-(2-methylquinazolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 6-[[4-[2-(2-methylquinazolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 6-[[4-[2-(2-methylquinazolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine CAS Name: 6-[[4-[2-[(2-methyl-5-quinazolinyl)oxy]ethyl]-1-piperazinyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 6-[[4-[2-(2-methylquinazolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 4-mesyl-6-[[4-[2-(2-methylquinazolin-5-yl)oxyethyl]piperazino]methyl]-2,3-dihydro-1,4-benzoxazine Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C(=N1)C=CC=C2OCCN3CCN(CC3)CC4=CC5=C(C=C4)OCCN5S(=O)(=O)C

Isomeric SMILES

CC1=NC=C2C(=N1)C=CC=C2OCCN3CCN(CC3)CC4=CC5=C(C=C4)OCCN5S(=O)(=O)C

InChI

InChI=1S/C25H31N5O4S/c1-19-26-17-21-22(27-19)4-3-5-24(21)33-14-12-28-8-10-29(11-9-28)18-20-6-7-25-23(16-20)30(13-15-34-25)35(2,31)32/h3-7,16-17H,8-15,18H2,1-2H3