4-(3-methylphenoxy)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]butanamide

Systemtic Name: 4-(3-methylphenoxy)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]butanamide Openeye Name: 4-(3-methylphenoxy)-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]butanamide CAS Name: 4-(3-methylphenoxy)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]butanamide IUPAC Name: 4-(3-methylphenoxy)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]butanamide Traditional Name: 4-(3-methylphenoxy)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]butyramide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H26N2O4S2/c1-16-6-4-7-17(14-16)26-13-5-8-19(23)21-15-18-9-10-20(27-18)28(24,25)22-11-2-3-12-22/h4,6-7,9-10,14H,2-3,5,8,11-13,15H2,1H3,(H,21,23)