diethyl-[2-[4-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-1-yl]ethyl]azanium

Systemtic Name: diethyl-[2-[4-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-6,7-dihydro-5H-cyclopenta[d]pyrimidin-1-yl]ethyl]azanium Openeye Name: diethyl-[2-[4-[2-(4-ethylanilino)-2-oxo-ethyl]sulfanyl-2-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-1-yl]ethyl]ammonium CAS Name: diethyl-[2-[4-[[2-(4-ethylanilino)-2-oxoethyl]thio]-2-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-1-yl]ethyl]ammonium IUPAC Name: diethyl-[2-[4-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-2-oxo-6,7-dihydro-5H-cyclopenta[d]pyrimidin-1-yl]ethyl]azanium Traditional Name: diethyl-[2-[4-[[2-(4-ethylanilino)-2-keto-ethyl]thio]-2-keto-6,7-dihydro-5H-cyclopenta[d]pyrimidin-1-yl]ethyl]ammonium Formula: C23H33N4O2S+ MolecularWeight: 429.59872

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)N(C3=C2CCC3)CC[NH+](CC)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)N(C3=C2CCC3)CC[NH+](CC)CC

InChI

InChI=1S/C23H32N4O2S/c1-4-17-10-12-18(13-11-17)24-21(28)16-30-22-19-8-7-9-20(19)27(23(29)25-22)15-14-26(5-2)6-3/h10-13H,4-9,14-16H2,1-3H3,(H,24,28)/p+1