1-[2-[2-[(2-azanyl-3-cyano-4,5-dimethyl-pyrrol-1-yl)methyl]phenyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea

Systemtic Name: 1-[2-[2-[(2-azanyl-3-cyano-4,5-dimethyl-pyrrol-1-yl)methyl]phenyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Openeye Name: 1-[2-[2-[(2-amino-3-cyano-4,5-dimethyl-pyrrol-1-yl)methyl]phenyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea CAS Name: 1-[2-[2-[(2-amino-3-cyano-4,5-dimethyl-1-pyrrolyl)methyl]phenyl]phenyl]-3-(6-phenyl-3-pyridazinyl)urea IUPAC Name: 1-[2-[2-[(2-amino-3-cyano-4,5-dimethylpyrrol-1-yl)methyl]phenyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Traditional Name: 1-[2-[2-[(2-amino-3-cyano-4,5-dimethyl-pyrrol-1-yl)methyl]phenyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Formula: C31H27N7O MolecularWeight: 513.59238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)N)CC2=CC=CC=C2C3=CC=CC=C3NC(=O)NC4=NN=C(C=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)N)CC2=CC=CC=C2C3=CC=CC=C3NC(=O)NC4=NN=C(C=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C31H27N7O/c1-20-21(2)38(30(33)26(20)18-32)19-23-12-6-7-13-24(23)25-14-8-9-15-28(25)34-31(39)35-29-17-16-27(36-37-29)22-10-4-3-5-11-22/h3-17H,19,33H2,1-2H3,(H2,34,35,37,39)