3-(4-tert-butylphenyl)-1,1-bis(pyridin-2-ylmethyl)thiourea

Systemtic Name: 3-(4-tert-butylphenyl)-1,1-bis(pyridin-2-ylmethyl)thiourea Openeye Name: 3-(4-tert-butylphenyl)-1,1-bis(2-pyridylmethyl)thiourea CAS Name: 3-(4-tert-butylphenyl)-1,1-bis(2-pyridinylmethyl)thiourea IUPAC Name: 3-(4-tert-butylphenyl)-1,1-bis(pyridin-2-ylmethyl)thiourea Traditional Name: 3-(4-tert-butylphenyl)-1,1-bis(2-pyridylmethyl)thiourea Formula: C23H26N4S MolecularWeight: 390.54434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=N2)CC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=S)N(CC2=CC=CC=N2)CC3=CC=CC=N3

InChI

InChI=1S/C23H26N4S/c1-23(2,3)18-10-12-19(13-11-18)26-22(28)27(16-20-8-4-6-14-24-20)17-21-9-5-7-15-25-21/h4-15H,16-17H2,1-3H3,(H,26,28)