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

Systemtic Name: 3-heptyl-1-(3-imidazol-1-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-heptyl-1-(3-imidazol-1-ylpropyl)-1-(4-pyridylmethyl)thiourea CAS Name: 3-heptyl-1-[3-(1-imidazolyl)propyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-heptyl-1-(3-imidazol-1-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-heptyl-1-(3-imidazol-1-ylpropyl)-1-(4-pyridylmethyl)thiourea Formula: C20H31N5S MolecularWeight: 373.55864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)N(CCCN1C=CN=C1)CC2=CC=NC=C2

Isomeric SMILES

CCCCCCCNC(=S)N(CCCN1C=CN=C1)CC2=CC=NC=C2

InChI

InChI=1S/C20H31N5S/c1-2-3-4-5-6-10-23-20(26)25(17-19-8-11-21-12-9-19)15-7-14-24-16-13-22-18-24/h8-9,11-13,16,18H,2-7,10,14-15,17H2,1H3,(H,23,26)