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

Systemtic Name: 1-[1-[1-[[(2S)-1-methylsulfonylpyrrolidin-2-yl]methyl]indol-5-yl]carbonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-[1-[[(2S)-1-methylsulfonylpyrrolidin-2-yl]methyl]indole-5-carbonyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-[[1-[[(2S)-1-methylsulfonyl-2-pyrrolidinyl]methyl]-5-indolyl]-oxomethyl]-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-[1-[[(2S)-1-methylsulfonylpyrrolidin-2-yl]methyl]indole-5-carbonyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-[1-[[(2S)-1-mesylpyrrolidin-2-yl]methyl]indole-5-carbonyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C28H32N4O5S MolecularWeight: 536.64248

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC1CN2C=CC3=C2C=CC(=C3)C(=O)N4CCC(CC4)N5C6=CC=CC=C6COC5=O

Isomeric SMILES

CS(=O)(=O)N1CCC[C@H]1CN2C=CC3=C2C=CC(=C3)C(=O)N4CCC(CC4)N5C6=CC=CC=C6COC5=O

InChI

InChI=1S/C28H32N4O5S/c1-38(35,36)31-13-4-6-24(31)18-30-14-10-20-17-21(8-9-25(20)30)27(33)29-15-11-23(12-16-29)32-26-7-3-2-5-22(26)19-37-28(32)34/h2-3,5,7-10,14,17,23-24H,4,6,11-13,15-16,18-19H2,1H3/t24-/m0/s1