1,3-bis[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]thiourea

Systemtic Name: 1,3-bis[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]thiourea Openeye Name: 1,3-bis[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]thiourea CAS Name: 1,3-bis[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]thiourea IUPAC Name: 1,3-bis[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]thiourea Traditional Name: 1,3-bis[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]thiourea Formula: C31H34N4O2S MolecularWeight: 526.69226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)OCCC4=NC=C(C=C4)CC

Isomeric SMILES

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)OCCC4=NC=C(C=C4)CC

InChI

InChI=1S/C31H34N4O2S/c1-3-23-5-7-25(32-21-23)17-19-36-29-13-9-27(10-14-29)34-31(38)35-28-11-15-30(16-12-28)37-20-18-26-8-6-24(4-2)22-33-26/h5-16,21-22H,3-4,17-20H2,1-2H3,(H2,34,35,38)