1-tert-butyl-3-[1-(phenylmethyl)piperidin-4-yl]thiourea

Systemtic Name: 1-tert-butyl-3-[1-(phenylmethyl)piperidin-4-yl]thiourea Openeye Name: 1-(1-benzyl-4-piperidyl)-3-tert-butyl-thiourea CAS Name: 1-tert-butyl-3-[1-(phenylmethyl)-4-piperidinyl]thiourea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-3-tert-butylthiourea Traditional Name: 1-(1-benzyl-4-piperidyl)-3-tert-butyl-thiourea Formula: C17H27N3S MolecularWeight: 305.48138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=S)NC1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C17H27N3S/c1-17(2,3)19-16(21)18-15-9-11-20(12-10-15)13-14-7-5-4-6-8-14/h4-8,15H,9-13H2,1-3H3,(H2,18,19,21)