[2-[cyclohexyl(phenyl)amino]-5-pentan-3-yloxy-1,3-benzothiazol-6-yl]iminoazanium

Systemtic Name: [2-[cyclohexyl(phenyl)amino]-5-pentan-3-yloxy-1,3-benzothiazol-6-yl]iminoazanium Openeye Name: [2-(N-cyclohexylanilino)-5-(1-ethylpropoxy)-1,3-benzothiazol-6-yl]iminoammonium CAS Name: [2-(N-cyclohexylanilino)-5-pentan-3-yloxy-1,3-benzothiazol-6-yl]iminoammonium IUPAC Name: [2-(N-cyclohexylanilino)-5-pentan-3-yloxy-1,3-benzothiazol-6-yl]iminoazanium Traditional Name: [2-(N-cyclohexylanilino)-5-(1-ethylpropoxy)-1,3-benzothiazol-6-yl]iminoammonium Formula: C24H31N4OS+ MolecularWeight: 423.59414

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=C(C=C2C(=C1)N=C(S2)N(C3CCCCC3)C4=CC=CC=C4)N=[NH2+]

Isomeric SMILES

CCC(CC)OC1=C(C=C2C(=C1)N=C(S2)N(C3CCCCC3)C4=CC=CC=C4)N=[NH2+]

InChI

InChI=1S/C24H30N4OS/c1-3-19(4-2)29-22-15-21-23(16-20(22)27-25)30-24(26-21)28(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5,7-8,11-12,15-16,18-19,25H,3-4,6,9-10,13-14H2,1-2H3/p+1