4-[methyl(thiophen-2-ylsulfonyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide

Systemtic Name: 4-[methyl(thiophen-2-ylsulfonyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide Openeye Name: 4-[methyl(2-thienylsulfonyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide CAS Name: 4-[methyl(thiophen-2-ylsulfonyl)amino]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]butanamide IUPAC Name: 4-[methyl(thiophen-2-ylsulfonyl)amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide Traditional Name: 4-[methyl(2-thienylsulfonyl)amino]-N-(4-pyrrolidinobenzyl)butyramide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NCC1=CC=C(C=C1)N2CCCC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CCCC(=O)NCC1=CC=C(C=C1)N2CCCC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H27N3O3S2/c1-22(28(25,26)20-7-5-15-27-20)12-4-6-19(24)21-16-17-8-10-18(11-9-17)23-13-2-3-14-23/h5,7-11,15H,2-4,6,12-14,16H2,1H3,(H,21,24)