3-(2-ethoxyphenyl)-1-[(4-propan-2-ylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(2-ethoxyphenyl)-1-[(4-propan-2-ylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(2-ethoxyphenyl)-1-[(4-isopropylphenyl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-(2-ethoxyphenyl)-1-[(4-propan-2-ylphenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(2-ethoxyphenyl)-1-[(4-propan-2-ylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(4-isopropylbenzyl)-3-o-phenetyl-1-(3-pyridylmethyl)thiourea Formula: C25H29N3OS MolecularWeight: 419.58226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N(CC2=CC=C(C=C2)C(C)C)CC3=CN=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N(CC2=CC=C(C=C2)C(C)C)CC3=CN=CC=C3

InChI

InChI=1S/C25H29N3OS/c1-4-29-24-10-6-5-9-23(24)27-25(30)28(18-21-8-7-15-26-16-21)17-20-11-13-22(14-12-20)19(2)3/h5-16,19H,4,17-18H2,1-3H3,(H,27,30)