piperidin-1-yl-[(2S)-4-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]methanone

Systemtic Name: piperidin-1-yl-[(2S)-4-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Openeye Name: 1-piperidyl-[(2S)-4-(4-pyrrolidin-1-ylsulfonylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone CAS Name: [(2S)-4-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: piperidin-1-yl-[(2S)-4-(4-pyrrolidin-1-ylsulfonylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Traditional Name: piperidino-[(2S)-4-(4-pyrrolidinosulfonylbenzoyl)-2,3-dihydro-1,4-benzoxazin-2-yl]methanone Formula: C25H29N3O5S MolecularWeight: 483.57986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H]2CN(C3=CC=CC=C3O2)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H29N3O5S/c29-24(19-10-12-20(13-11-19)34(31,32)27-16-6-7-17-27)28-18-23(25(30)26-14-4-1-5-15-26)33-22-9-3-2-8-21(22)28/h2-3,8-13,23H,1,4-7,14-18H2/t23-/m0/s1