1-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-propan-2-yl-thiourea

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-propan-2-yl-thiourea Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-isopropyl-thiourea CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-propan-2-ylthiourea IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-propan-2-ylthiourea Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-3-isopropyl-thiourea Formula: C16H26N3S+ MolecularWeight: 292.46274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=S)NC1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H25N3S/c1-13(2)17-16(20)18-15-8-10-19(11-9-15)12-14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H2,17,18,20)/p+1