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

Systemtic Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-4-[(4-methylthiazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-4-[[(4-methyl-2-thiazolyl)thio]methyl]benzamide IUPAC Name: N-(2-methyl-4-pyrrolidin-1-ylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(2-methyl-4-pyrrolidino-phenyl)-4-[[(4-methylthiazol-2-yl)thio]methyl]benzamide Formula: C23H25N3OS2 MolecularWeight: 423.5941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)CSC4=NC(=CS4)C

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=CC=C(C=C3)CSC4=NC(=CS4)C

InChI

InChI=1S/C23H25N3OS2/c1-16-13-20(26-11-3-4-12-26)9-10-21(16)25-22(27)19-7-5-18(6-8-19)15-29-23-24-17(2)14-28-23/h5-10,13-14H,3-4,11-12,15H2,1-2H3,(H,25,27)