N-(3,4-diethoxyphenyl)-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide

Systemtic Name: N-(3,4-diethoxyphenyl)-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide Openeye Name: N-(3,4-diethoxyphenyl)-4-[6-(2-thienyl)pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(3,4-diethoxyphenyl)-4-(6-thiophen-2-yl-3-pyridazinyl)-1-piperazinecarboxamide IUPAC Name: N-(3,4-diethoxyphenyl)-4-(6-thiophen-2-ylpyridazin-3-yl)piperazine-1-carboxamide Traditional Name: N-(3,4-diethoxyphenyl)-4-[6-(2-thienyl)pyridazin-3-yl]piperazine-1-carboxamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=CS4)OCC

InChI

InChI=1S/C23H27N5O3S/c1-3-30-19-9-7-17(16-20(19)31-4-2)24-23(29)28-13-11-27(12-14-28)22-10-8-18(25-26-22)21-6-5-15-32-21/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,24,29)