ethyl 4-naphthalen-2-yl-2-[[2-[(6-phenylpyridazin-3-yl)carbamothioylamino]phenyl]amino]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-naphthalen-2-yl-2-[[2-[(6-phenylpyridazin-3-yl)carbamothioylamino]phenyl]amino]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(2-naphthyl)-2-[2-[(6-phenylpyridazin-3-yl)carbamothioylamino]anilino]-1H-pyrrole-3-carboxylate CAS Name: 4-(2-naphthalenyl)-2-[2-[[[(6-phenyl-3-pyridazinyl)amino]-sulfanylidenemethyl]amino]anilino]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-naphthalen-2-yl-2-[2-[(6-phenylpyridazin-3-yl)carbamothioylamino]anilino]-1H-pyrrole-3-carboxylate Traditional Name: 4-(2-naphthyl)-2-[2-[(6-phenylpyridazin-3-yl)thiocarbamoylamino]anilino]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C34H28N6O2S MolecularWeight: 584.69012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC=C1C2=CC3=CC=CC=C3C=C2)NC4=CC=CC=C4NC(=S)NC5=NN=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=C(NC=C1C2=CC3=CC=CC=C3C=C2)NC4=CC=CC=C4NC(=S)NC5=NN=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H28N6O2S/c1-2-42-33(41)31-26(25-17-16-22-10-6-7-13-24(22)20-25)21-35-32(31)36-28-14-8-9-15-29(28)37-34(43)38-30-19-18-27(39-40-30)23-11-4-3-5-12-23/h3-21,35-36H,2H2,1H3,(H2,37,38,40,43)