2-[4-(2,5-dimethylthiophen-3-yl)sulfonyl-1,4-diazepan-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(2,5-dimethylthiophen-3-yl)sulfonyl-1,4-diazepan-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[(2,5-dimethyl-3-thienyl)sulfonyl]-1,4-diazepan-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(2,5-dimethyl-3-thiophenyl)sulfonyl]-1,4-diazepan-1-yl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(2,5-dimethylthiophen-3-yl)sulfonyl-1,4-diazepan-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[(2,5-dimethyl-3-thienyl)sulfonyl]-1,4-diazepan-1-yl]-1-pyrrolidino-ethanone Formula: C17H27N3O3S2 MolecularWeight: 385.54458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)S(=O)(=O)N2CCCN(CC2)CC(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(S1)C)S(=O)(=O)N2CCCN(CC2)CC(=O)N3CCCC3

InChI

InChI=1S/C17H27N3O3S2/c1-14-12-16(15(2)24-14)25(22,23)20-9-5-6-18(10-11-20)13-17(21)19-7-3-4-8-19/h12H,3-11,13H2,1-2H3