N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-[(4-methylthiazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4-[[(4-methyl-2-thiazolyl)thio]methyl]benzamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-4-[[(4-methylthiazol-2-yl)thio]methyl]benzamide Formula: C25H29N3O2S2 MolecularWeight: 467.64666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NCC(C3=CC(=CC=C3)OC)N4CCCC4

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NCC(C3=CC(=CC=C3)OC)N4CCCC4

InChI

InChI=1S/C25H29N3O2S2/c1-18-16-31-25(27-18)32-17-19-8-10-20(11-9-19)24(29)26-15-23(28-12-3-4-13-28)21-6-5-7-22(14-21)30-2/h5-11,14,16,23H,3-4,12-13,15,17H2,1-2H3,(H,26,29)