1-[[(2R)-oxolan-2-yl]methyl]-3-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]thiourea

Systemtic Name: 1-[[(2R)-oxolan-2-yl]methyl]-3-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]thiourea Openeye Name: 1-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[[(2R)-2-oxolanyl]methyl]-3-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]thiourea IUPAC Name: 1-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C18H27N4OS+ MolecularWeight: 347.49818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NN=C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](OC1)CNC(=S)NN=C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H26N4OS/c24-18(19-13-17-7-4-12-23-17)21-20-16-8-10-22(11-9-16)14-15-5-2-1-3-6-15/h1-3,5-6,17H,4,7-14H2,(H2,19,21,24)/p+1/t17-/m1/s1