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

Systemtic Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[(4-methylthiazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-2-[[(4-methyl-2-thiazolyl)thio]methyl]benzamide IUPAC Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-[3-(cyclopropylcarbamoyl)phenyl]-2-[[(4-methylthiazol-2-yl)thio]methyl]benzamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C(=O)NC4CC4

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C(=O)NC4CC4

InChI

InChI=1S/C22H21N3O2S2/c1-14-12-28-22(23-14)29-13-16-5-2-3-8-19(16)21(27)25-18-7-4-6-15(11-18)20(26)24-17-9-10-17/h2-8,11-12,17H,9-10,13H2,1H3,(H,24,26)(H,25,27)