1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-(3-pyridylmethyl)thiourea Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C17H18N4OS/c1-22-16-7-5-15(6-8-16)20-17(23)21(11-3-9-18)13-14-4-2-10-19-12-14/h2,4-8,10,12H,3,11,13H2,1H3,(H,20,23)