3-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one

Systemtic Name: 3-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one Openeye Name: 3-[3-(4-benzylpiperazin-1-yl)-3-oxo-propyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one CAS Name: 3-[3-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-2-one IUPAC Name: 3-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-2-one Traditional Name: 3-[3-(4-benzylpiperazino)-3-keto-propyl]-6-pyrrolidinosulfonyl-1,3-benzoxazol-2-one Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCC(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H30N4O5S/c30-24(27-16-14-26(15-17-27)19-20-6-2-1-3-7-20)10-13-29-22-9-8-21(18-23(22)34-25(29)31)35(32,33)28-11-4-5-12-28/h1-3,6-9,18H,4-5,10-17,19H2