methyl 2-[1-[(2-butyl-1,3-thiazol-4-yl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[(2-butyl-1,3-thiazol-4-yl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-[(2-butylthiazol-4-yl)methyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(2-butyl-4-thiazolyl)methyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[(2-butyl-1,3-thiazol-4-yl)methyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[(2-butylthiazol-4-yl)methyl]-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C15H23N3O3S MolecularWeight: 325.42642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CS1)CN2CCNC(=O)C2CC(=O)OC

Isomeric SMILES

CCCCC1=NC(=CS1)CN2CCNC(=O)C2CC(=O)OC

InChI

InChI=1S/C15H23N3O3S/c1-3-4-5-13-17-11(10-22-13)9-18-7-6-16-15(20)12(18)8-14(19)21-2/h10,12H,3-9H2,1-2H3,(H,16,20)