3-(2-methylpropyl)-1-(phenylmethyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(2-methylpropyl)-1-(phenylmethyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-benzyl-3-isobutyl-1-(4-pyridylmethyl)thiourea CAS Name: 3-(2-methylpropyl)-1-(phenylmethyl)-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-benzyl-3-(2-methylpropyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-benzyl-3-isobutyl-1-(4-pyridylmethyl)thiourea Formula: C18H23N3S MolecularWeight: 313.46032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)N(CC1=CC=CC=C1)CC2=CC=NC=C2

Isomeric SMILES

CC(C)CNC(=S)N(CC1=CC=CC=C1)CC2=CC=NC=C2

InChI

InChI=1S/C18H23N3S/c1-15(2)12-20-18(22)21(13-16-6-4-3-5-7-16)14-17-8-10-19-11-9-17/h3-11,15H,12-14H2,1-2H3,(H,20,22)