3-[2-(3,4-diethoxyphenyl)ethyl]-1,1-bis(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1,1-bis(pyridin-3-ylmethyl)thiourea Openeye Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1,1-bis(3-pyridylmethyl)thiourea CAS Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1,1-bis(3-pyridinylmethyl)thiourea IUPAC Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1,1-bis(pyridin-3-ylmethyl)thiourea Traditional Name: 3-[2-(3,4-diethoxyphenyl)ethyl]-1,1-bis(3-pyridylmethyl)thiourea Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=S)N(CC2=CN=CC=C2)CC3=CN=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=S)N(CC2=CN=CC=C2)CC3=CN=CC=C3)OCC

InChI

InChI=1S/C25H30N4O2S/c1-3-30-23-10-9-20(15-24(23)31-4-2)11-14-28-25(32)29(18-21-7-5-12-26-16-21)19-22-8-6-13-27-17-22/h5-10,12-13,15-17H,3-4,11,14,18-19H2,1-2H3,(H,28,32)