1-[2-[(5-chloranylpyrimidin-2-yl)amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea

Systemtic Name: 1-[2-[(5-chloranylpyrimidin-2-yl)amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Openeye Name: 1-[2-[(5-chloropyrimidin-2-yl)amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea CAS Name: 1-[2-[(5-chloro-2-pyrimidinyl)amino]phenyl]-3-(6-phenyl-3-pyridazinyl)thiourea IUPAC Name: 1-[2-[(5-chloropyrimidin-2-yl)amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Traditional Name: 1-[2-[(5-chloropyrimidin-2-yl)amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Formula: C21H16ClN7S MolecularWeight: 433.91664

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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=NC=C(C=N4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=S)NC3=CC=CC=C3NC4=NC=C(C=N4)Cl

InChI

InChI=1S/C21H16ClN7S/c22-15-12-23-20(24-13-15)25-17-8-4-5-9-18(17)26-21(30)27-19-11-10-16(28-29-19)14-6-2-1-3-7-14/h1-13H,(H,23,24,25)(H2,26,27,29,30)