1-[1-[1-[(4-methylsulfonylpiperazin-1-yl)methyl]indol-5-yl]carbonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-[1-[(4-methylsulfonylpiperazin-1-yl)methyl]indol-5-yl]carbonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-[1-[(4-methylsulfonylpiperazin-1-yl)methyl]indole-5-carbonyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-[[1-[(4-methylsulfonyl-1-piperazinyl)methyl]-5-indolyl]-oxomethyl]-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-[1-[(4-methylsulfonylpiperazin-1-yl)methyl]indole-5-carbonyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-[1-[(4-mesylpiperazino)methyl]indole-5-carbonyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C28H33N5O5S MolecularWeight: 551.65712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CN2C=CC3=C2C=CC(=C3)C(=O)N4CCC(CC4)N5C6=CC=CC=C6COC5=O

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CN2C=CC3=C2C=CC(=C3)C(=O)N4CCC(CC4)N5C6=CC=CC=C6COC5=O

InChI

InChI=1S/C28H33N5O5S/c1-39(36,37)32-16-14-29(15-17-32)20-31-11-8-21-18-22(6-7-25(21)31)27(34)30-12-9-24(10-13-30)33-26-5-3-2-4-23(26)19-38-28(33)35/h2-8,11,18,24H,9-10,12-17,19-20H2,1H3