1-octadecyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea

Systemtic Name: 1-octadecyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea Openeye Name: 1-octadecyl-3-[(E)-4-pyridylmethyleneamino]thiourea CAS Name: 1-octadecyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea IUPAC Name: 1-octadecyl-3-[(E)-pyridin-4-ylmethylideneamino]thiourea Traditional Name: 1-[(E)-4-pyridylmethyleneamino]-3-stearyl-thiourea Formula: C25H44N4S MolecularWeight: 432.70866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=S)NN=CC1=CC=NC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=S)N/N=C/C1=CC=NC=C1

InChI

InChI=1S/C25H44N4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-27-25(30)29-28-23-24-18-21-26-22-19-24/h18-19,21-23H,2-17,20H2,1H3,(H2,27,29,30)/b28-23+