3-[[(4-methoxyphenyl)-[(4-propan-2-ylphenyl)methyl]carbamothioyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4-methoxyphenyl)-[(4-propan-2-ylphenyl)methyl]carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(4-isopropylphenyl)methyl-(4-methoxyphenyl)carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-methoxy-N-[(4-propan-2-ylphenyl)methyl]anilino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(4-methoxyphenyl)-[(4-propan-2-ylphenyl)methyl]carbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(4-isopropylbenzyl)-(4-methoxyphenyl)thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C23H34N3OS+ MolecularWeight: 400.60056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)OC)C(=S)NCCC[NH+](C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)OC)C(=S)NCCC[NH+](C)C

InChI

InChI=1S/C23H33N3OS/c1-18(2)20-9-7-19(8-10-20)17-26(21-11-13-22(27-5)14-12-21)23(28)24-15-6-16-25(3)4/h7-14,18H,6,15-17H2,1-5H3,(H,24,28)/p+1