1-(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)-N-methyl-N-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methyl]methanamine

Systemtic Name: 1-(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)-N-methyl-N-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methyl]methanamine Openeye Name: 1-(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)-N-methyl-N-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methyl]methanamine CAS Name: 1-(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)-N-methyl-N-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methyl]methanamine IUPAC Name: 1-(4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)-N-methyl-N-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methyl]methanamine Traditional Name: (4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl)methyl-methyl-[(5-pyrrolidinosulfonyl-2-furyl)methyl]amine Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)CC3=CC=C(O3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCN1CC(OC2=CC=CC=C21)CN(C)CC3=CC=C(O3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H29N3O4S/c1-3-23-16-18(27-20-9-5-4-8-19(20)23)15-22(2)14-17-10-11-21(28-17)29(25,26)24-12-6-7-13-24/h4-5,8-11,18H,3,6-7,12-16H2,1-2H3