2-[2-methoxy-4-(4-methylpiperazin-1-yl)carbothioyl-phenoxy]-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[2-methoxy-4-(4-methylpiperazin-1-yl)carbothioyl-phenoxy]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[2-methoxy-4-(4-methylpiperazine-1-carbothioyl)phenoxy]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[2-methoxy-4-[(4-methyl-1-piperazinyl)-sulfanylidenemethyl]phenoxy]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[2-methoxy-4-(4-methylpiperazine-1-carbothioyl)phenoxy]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[2-methoxy-4-(4-methylpiperazine-1-carbothioyl)phenoxy]-N-(3-methoxyphenyl)acetamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)C2=CC(=C(C=C2)OCC(=O)NC3=CC(=CC=C3)OC)OC

Isomeric SMILES

CN1CCN(CC1)C(=S)C2=CC(=C(C=C2)OCC(=O)NC3=CC(=CC=C3)OC)OC

InChI

InChI=1S/C22H27N3O4S/c1-24-9-11-25(12-10-24)22(30)16-7-8-19(20(13-16)28-3)29-15-21(26)23-17-5-4-6-18(14-17)27-2/h4-8,13-14H,9-12,15H2,1-3H3,(H,23,26)