2-methyl-N-[3-oxidanylidene-3-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methylamino]propyl]benzamide

Systemtic Name: 2-methyl-N-[3-oxidanylidene-3-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methylamino]propyl]benzamide Openeye Name: 2-methyl-N-[3-oxo-3-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methylamino]propyl]benzamide CAS Name: 2-methyl-N-[3-oxo-3-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methylamino]propyl]benzamide IUPAC Name: 2-methyl-N-[3-oxo-3-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methylamino]propyl]benzamide Traditional Name: N-[3-keto-3-[(5-pyrrolidinosulfonyl-2-thienyl)methylamino]propyl]-2-methyl-benzamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H25N3O4S2/c1-15-6-2-3-7-17(15)20(25)21-11-10-18(24)22-14-16-8-9-19(28-16)29(26,27)23-12-4-5-13-23/h2-3,6-9H,4-5,10-14H2,1H3,(H,21,25)(H,22,24)