N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-(5-methyl-2-thienyl)-4-oxo-butanamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4-(5-methyl-2-thiophenyl)-4-oxobutanamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-(5-methylthiophen-2-yl)-4-oxobutanamide Traditional Name: 4-keto-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-4-(5-methyl-2-thienyl)butyramide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)NCC(C2=CC(=CC=C2)OC)N3CCCC3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)NCC(C2=CC(=CC=C2)OC)N3CCCC3

InChI

InChI=1S/C22H28N2O3S/c1-16-8-10-21(28-16)20(25)9-11-22(26)23-15-19(24-12-3-4-13-24)17-6-5-7-18(14-17)27-2/h5-8,10,14,19H,3-4,9,11-13,15H2,1-2H3,(H,23,26)