N-[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-[1-benzyl-2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-5-(2-thienyl)isoxazole-3-carboxamide CAS Name: N-[1-(4-methyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]-5-thiophen-2-yl-3-isoxazolecarboxamide IUPAC Name: N-[1-(4-methylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-[1-benzyl-2-keto-2-(4-methylpiperazino)ethyl]-5-(2-thienyl)isoxazole-3-carboxamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)C3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CN1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)C3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C22H24N4O3S/c1-25-9-11-26(12-10-25)22(28)18(14-16-6-3-2-4-7-16)23-21(27)17-15-19(29-24-17)20-8-5-13-30-20/h2-8,13,15,18H,9-12,14H2,1H3,(H,23,27)