1-(3-imidazol-1-ylpropyl)-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(3-imidazol-1-ylpropyl)-3-(4-methoxyphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[3-(1-imidazolyl)propyl]-3-(4-methoxyphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(3-imidazol-1-ylpropyl)-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(3-imidazol-1-ylpropyl)-3-(4-methoxyphenyl)-1-(3-pyridylmethyl)thiourea Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CN=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CN=CC=C3

InChI

InChI=1S/C20H23N5OS/c1-26-19-7-5-18(6-8-19)23-20(27)25(15-17-4-2-9-21-14-17)12-3-11-24-13-10-22-16-24/h2,4-10,13-14,16H,3,11-12,15H2,1H3,(H,23,27)