3-[[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-cyclopentyl-carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-cyclopentyl-carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-cyclopentyl-carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-cyclopentylamino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-cyclopentylcarbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-cyclopentyl-thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C19H35N6O2S+ MolecularWeight: 411.5852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=S)NCCC[NH+](C)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C2CCCC2)C(=S)NCCC[NH+](C)C)N

InChI

InChI=1S/C19H34N6O2S/c1-4-5-13-24-16(20)15(17(26)22-18(24)27)25(14-9-6-7-10-14)19(28)21-11-8-12-23(2)3/h14H,4-13,20H2,1-3H3,(H,21,28)(H,22,26,27)/p+1