4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-3-one Openeye Name: 4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-3-one CAS Name: 4-[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-6-(1-pyrrolidinylsulfonyl)-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-3-one Traditional Name: 4-[2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl]-6-pyrrolidinosulfonyl-1,4-benzoxazin-3-one Formula: C25H30N4O6S MolecularWeight: 514.5939

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CN3C(=O)COC4=C3C=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H30N4O6S/c1-34-22-7-3-2-6-20(22)26-12-14-27(15-13-26)24(30)17-29-21-16-19(8-9-23(21)35-18-25(29)31)36(32,33)28-10-4-5-11-28/h2-3,6-9,16H,4-5,10-15,17-18H2,1H3