1-(6-phenylpyridazin-3-yl)-3-[2-(quinoxalin-6-ylamino)phenyl]thiourea

Systemtic Name: 1-(6-phenylpyridazin-3-yl)-3-[2-(quinoxalin-6-ylamino)phenyl]thiourea Openeye Name: 1-(6-phenylpyridazin-3-yl)-3-[2-(quinoxalin-6-ylamino)phenyl]thiourea CAS Name: 1-(6-phenyl-3-pyridazinyl)-3-[2-(6-quinoxalinylamino)phenyl]thiourea IUPAC Name: 1-(6-phenylpyridazin-3-yl)-3-[2-(quinoxalin-6-ylamino)phenyl]thiourea Traditional Name: 1-(6-phenylpyridazin-3-yl)-3-[2-(quinoxalin-6-ylamino)phenyl]thiourea Formula: C25H19N7S MolecularWeight: 449.53026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=S)NC3=CC=CC=C3NC4=CC5=NC=CN=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=S)NC3=CC=CC=C3NC4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C25H19N7S/c33-25(30-24-13-12-19(31-32-24)17-6-2-1-3-7-17)29-22-9-5-4-8-21(22)28-18-10-11-20-23(16-18)27-15-14-26-20/h1-16,28H,(H2,29,30,32,33)