[[4-[(4-butan-2-ylsulfanylphenyl)carbamoylamino]phenyl]amino]azanium

Systemtic Name: [[4-[(4-butan-2-ylsulfanylphenyl)carbamoylamino]phenyl]amino]azanium Openeye Name: [4-[(4-sec-butylsulfanylphenyl)carbamoylamino]anilino]ammonium CAS Name: [4-[[[4-(butan-2-ylthio)anilino]-oxomethyl]amino]anilino]ammonium IUPAC Name: [4-[(4-butan-2-ylsulfanylphenyl)carbamoylamino]anilino]azanium Traditional Name: [4-[[4-(sec-butylthio)phenyl]carbamoylamino]anilino]ammonium Formula: C17H23N4OS+ MolecularWeight: 331.45572

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)N[NH3+]

Isomeric SMILES

CCC(C)SC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)N[NH3+]

InChI

InChI=1S/C17H22N4OS/c1-3-12(2)23-16-10-8-14(9-11-16)20-17(22)19-13-4-6-15(21-18)7-5-13/h4-12,21H,3,18H2,1-2H3,(H2,19,20,22)/p+1