N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[2-[4-(m-tolyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[2-[4-(3-methylphenyl)-1-piperazinyl]-2-oxoethyl]thio]propanamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl]sulfanylpropanamide Traditional Name: 2-[[2-keto-2-[4-(m-tolyl)piperazino]ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC(C)C(=O)NC3=NOC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC(C)C(=O)NC3=NOC(=C3)C

InChI

InChI=1S/C20H26N4O3S/c1-14-5-4-6-17(11-14)23-7-9-24(10-8-23)19(25)13-28-16(3)20(26)21-18-12-15(2)27-22-18/h4-6,11-12,16H,7-10,13H2,1-3H3,(H,21,22,26)