1-cyclopropyl-3-octan-3-yl-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-cyclopropyl-3-octan-3-yl-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-cyclopropyl-3-(1-ethylhexyl)-1-(4-pyridylmethyl)thiourea CAS Name: 1-cyclopropyl-3-octan-3-yl-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-cyclopropyl-3-octan-3-yl-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-cyclopropyl-3-(1-ethylhexyl)-1-(4-pyridylmethyl)thiourea Formula: C18H29N3S MolecularWeight: 319.50796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)NC(=S)N(CC1=CC=NC=C1)C2CC2

Isomeric SMILES

CCCCCC(CC)NC(=S)N(CC1=CC=NC=C1)C2CC2

InChI

InChI=1S/C18H29N3S/c1-3-5-6-7-16(4-2)20-18(22)21(17-8-9-17)14-15-10-12-19-13-11-15/h10-13,16-17H,3-9,14H2,1-2H3,(H,20,22)