1-(4-butoxyphenyl)-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea

Systemtic Name: 1-(4-butoxyphenyl)-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea Openeye Name: 1-(4-butoxyphenyl)-3-[4-(4-pyridylmethyl)phenyl]thiourea CAS Name: 1-(4-butoxyphenyl)-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea IUPAC Name: 1-(4-butoxyphenyl)-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea Traditional Name: 1-(4-butoxyphenyl)-3-[4-(4-pyridylmethyl)phenyl]thiourea Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C23H25N3OS/c1-2-3-16-27-22-10-8-21(9-11-22)26-23(28)25-20-6-4-18(5-7-20)17-19-12-14-24-15-13-19/h4-15H,2-3,16-17H2,1H3,(H2,25,26,28)