N-(4-phenylbutan-2-yl)-N-(1,3-thiazol-2-ylmethyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(4-phenylbutan-2-yl)-N-(1,3-thiazol-2-ylmethyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(1-methyl-3-phenyl-propyl)-N-(thiazol-2-ylmethyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-(4-phenylbutan-2-yl)-N-(2-thiazolylmethyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(4-phenylbutan-2-yl)-N-(1,3-thiazol-2-ylmethyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(1-methyl-3-phenyl-propyl)-N-(thiazol-2-ylmethyl)-1,3-benzothiazole-6-carboxamide Formula: C22H21N3OS2 MolecularWeight: 407.55164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N(CC2=NC=CS2)C(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CC(CCC1=CC=CC=C1)N(CC2=NC=CS2)C(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C22H21N3OS2/c1-16(7-8-17-5-3-2-4-6-17)25(14-21-23-11-12-27-21)22(26)18-9-10-19-20(13-18)28-15-24-19/h2-6,9-13,15-16H,7-8,14H2,1H3