1-[4-(2-methylpropoxy)phenyl]-3-(4-pyridin-2-ylphenyl)thiourea; pyridine-4-carbohydrazide

Systemtic Name: 1-[4-(2-methylpropoxy)phenyl]-3-(4-pyridin-2-ylphenyl)thiourea; pyridine-4-carbohydrazide Openeye Name: 1-(4-isobutoxyphenyl)-3-[4-(2-pyridyl)phenyl]thiourea; pyridine-4-carbohydrazide CAS Name: 1-[4-(2-methylpropoxy)phenyl]-3-[4-(2-pyridinyl)phenyl]thiourea; 4-pyridinecarbohydrazide IUPAC Name: 1-[4-(2-methylpropoxy)phenyl]-3-(4-pyridin-2-ylphenyl)thiourea; pyridine-4-carbohydrazide Traditional Name: 1-(4-isobutoxyphenyl)-3-[4-(2-pyridyl)phenyl]thiourea; isonicotinohydrazide Formula: C28H30N6O2S MolecularWeight: 514.6418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=CC=CC=N3.C1=CN=CC=C1C(=O)NN

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=CC=CC=N3.C1=CN=CC=C1C(=O)NN

InChI

InChI=1S/C22H23N3OS.C6H7N3O/c1-16(2)15-26-20-12-10-19(11-13-20)25-22(27)24-18-8-6-17(7-9-18)21-5-3-4-14-23-21;7-9-6(10)5-1-3-8-4-2-5/h3-14,16H,15H2,1-2H3,(H2,24,25,27);1-4H,7H2,(H,9,10)