1-(3-methoxyphenyl)-3-[(1-propylpiperidin-1-ium-4-ylidene)amino]thiourea

Systemtic Name: 1-(3-methoxyphenyl)-3-[(1-propylpiperidin-1-ium-4-ylidene)amino]thiourea Openeye Name: 1-(3-methoxyphenyl)-3-[(1-propylpiperidin-1-ium-4-ylidene)amino]thiourea CAS Name: 1-(3-methoxyphenyl)-3-[(1-propyl-4-piperidin-1-iumylidene)amino]thiourea IUPAC Name: 1-(3-methoxyphenyl)-3-[(1-propylpiperidin-1-ium-4-ylidene)amino]thiourea Traditional Name: 1-(3-methoxyphenyl)-3-[(1-propylpiperidin-1-ium-4-ylidene)amino]thiourea Formula: C16H25N4OS+ MolecularWeight: 321.4609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(=NNC(=S)NC2=CC(=CC=C2)OC)CC1

Isomeric SMILES

CCC[NH+]1CCC(=NNC(=S)NC2=CC(=CC=C2)OC)CC1

InChI

InChI=1S/C16H24N4OS/c1-3-9-20-10-7-13(8-11-20)18-19-16(22)17-14-5-4-6-15(12-14)21-2/h4-6,12H,3,7-11H2,1-2H3,(H2,17,19,22)/p+1