[3-ethoxy-4-(2-methylpropoxy)phenyl]-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (3-ethoxy-4-isobutoxy-phenyl)-[4-(4-methylthiazol-2-yl)piperazin-1-yl]methanone CAS Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-[4-(4-methyl-2-thiazolyl)-1-piperazinyl]methanone IUPAC Name: [3-ethoxy-4-(2-methylpropoxy)phenyl]-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (3-ethoxy-4-isobutoxy-phenyl)-[4-(4-methylthiazol-2-yl)piperazino]methanone Formula: C21H29N3O3S MolecularWeight: 403.53826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=NC(=CS3)C)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C3=NC(=CS3)C)OCC(C)C

InChI

InChI=1S/C21H29N3O3S/c1-5-26-19-12-17(6-7-18(19)27-13-15(2)3)20(25)23-8-10-24(11-9-23)21-22-16(4)14-28-21/h6-7,12,14-15H,5,8-11,13H2,1-4H3