6-chloranyl-N-[1-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)-2-oxidanylidene-pyrrolidin-3-yl]-N-(2-pyrrolidin-1-ylethyl)naphthalene-2-sulfonamide methanoate

Systemtic Name: 6-chloranyl-N-[1-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)-2-oxidanylidene-pyrrolidin-3-yl]-N-(2-pyrrolidin-1-ylethyl)naphthalene-2-sulfonamide methanoate Openeye Name: 6-chloro-N-[1-(1-methyl-2-morpholino-2-oxo-ethyl)-2-oxo-pyrrolidin-3-yl]-N-(2-pyrrolidin-1-ylethyl)naphthalene-2-sulfonamide formate CAS Name: 6-chloro-N-[1-[1-(4-morpholinyl)-1-oxopropan-2-yl]-2-oxo-3-pyrrolidinyl]-N-[2-(1-pyrrolidinyl)ethyl]-2-naphthalenesulfonamide formate IUPAC Name: 6-chloro-N-[1-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-oxopyrrolidin-3-yl]-N-(2-pyrrolidin-1-ylethyl)naphthalene-2-sulfonamide formate Traditional Name: 6-chloro-N-[2-keto-1-(2-keto-1-methyl-2-morpholino-ethyl)pyrrolidin-3-yl]-N-(2-pyrrolidinoethyl)naphthalene-2-sulfonamide formate Formula: C28H36ClN4O7S- MolecularWeight: 608.12604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)N2CCC(C2=O)N(CCN3CCCC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.C(=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCOCC1)N2CCC(C2=O)N(CCN3CCCC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.C(=O)[O-]

InChI

InChI=1S/C27H35ClN4O5S.CH2O2/c1-20(26(33)30-14-16-37-17-15-30)31-11-8-25(27(31)34)32(13-12-29-9-2-3-10-29)38(35,36)24-7-5-21-18-23(28)6-4-22(21)19-24;2-1-3/h4-7,18-20,25H,2-3,8-17H2,1H3;1H,(H,2,3)/p-1