3-(3-methoxyphenyl)-1-(pyridin-3-ylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea

Systemtic Name: 3-(3-methoxyphenyl)-1-(pyridin-3-ylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Openeye Name: 3-(3-methoxyphenyl)-1-(3-pyridylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea CAS Name: 3-(3-methoxyphenyl)-1-(3-pyridinylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea IUPAC Name: 3-(3-methoxyphenyl)-1-(pyridin-3-ylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]thiourea Traditional Name: 3-(3-methoxyphenyl)-1-(3-pyridylmethyl)-1-(2,3,4-trimethoxybenzyl)thiourea Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3=CC(=CC=C3)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3=CC(=CC=C3)OC)OC)OC

InChI

InChI=1S/C24H27N3O4S/c1-28-20-9-5-8-19(13-20)26-24(32)27(15-17-7-6-12-25-14-17)16-18-10-11-21(29-2)23(31-4)22(18)30-3/h5-14H,15-16H2,1-4H3,(H,26,32)