3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)propanamide

Systemtic Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)propanamide Openeye Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]propanamide CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]propanamide IUPAC Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)propanamide Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]-N-[2-pyrrolidino-2-(2-thienyl)ethyl]propionamide Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NCC(C2=CC=CS2)N3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NCC(C2=CC=CS2)N3CCCC3)C

InChI

InChI=1S/C21H29N3O3S2/c1-16-7-8-18(14-17(16)2)29(26,27)23-10-9-21(25)22-15-19(20-6-5-13-28-20)24-11-3-4-12-24/h5-8,13-14,19,23H,3-4,9-12,15H2,1-2H3,(H,22,25)