1-prop-2-enyl-3-[3-[4-[3-(prop-2-enylcarbamothioylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea

Systemtic Name: 1-prop-2-enyl-3-[3-[4-[3-(prop-2-enylcarbamothioylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea Openeye Name: 1-allyl-3-[3-[4-[3-(allylcarbamothioylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea CAS Name: 1-prop-2-enyl-3-[3-[4-[3-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]propyl]-1-piperazin-1-iumyl]propyl]thiourea IUPAC Name: 1-prop-2-enyl-3-[3-[4-[3-(prop-2-enylcarbamothioylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea Traditional Name: 1-allyl-3-[3-[4-[3-(allylthiocarbamoylamino)propyl]piperazin-1-ium-1-yl]propyl]thiourea Formula: C18H35N6S2+ MolecularWeight: 399.6407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NCCC[NH+]1CCN(CC1)CCCNC(=S)NCC=C

Isomeric SMILES

C=CCNC(=S)NCCC[NH+]1CCN(CC1)CCCNC(=S)NCC=C

InChI

InChI=1S/C18H34N6S2/c1-3-7-19-17(25)21-9-5-11-23-13-15-24(16-14-23)12-6-10-22-18(26)20-8-4-2/h3-4H,1-2,5-16H2,(H2,19,21,25)(H2,20,22,26)/p+1