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

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]butanamide Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]butanamide CAS Name: 4-(4-chloro-3-methylphenoxy)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]butanamide IUPAC Name: 4-(4-chloro-3-methylphenoxy)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]butanamide Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]butyramide Formula: C20H25ClN2O4S2 MolecularWeight: 457.0065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN2O4S2/c1-15-13-16(6-8-18(15)21)27-12-4-5-19(24)22-14-17-7-9-20(28-17)29(25,26)23-10-2-3-11-23/h6-9,13H,2-5,10-12,14H2,1H3,(H,22,24)