[2-azanylidene-5-pentan-3-yloxy-3-(phenylmethyl)-1,3-benzothiazol-6-yl]iminoazanium

Systemtic Name: [2-azanylidene-5-pentan-3-yloxy-3-(phenylmethyl)-1,3-benzothiazol-6-yl]iminoazanium Openeye Name: [3-benzyl-5-(1-ethylpropoxy)-2-imino-1,3-benzothiazol-6-yl]iminoammonium CAS Name: [2-imino-5-pentan-3-yloxy-3-(phenylmethyl)-1,3-benzothiazol-6-yl]iminoammonium IUPAC Name: (3-benzyl-2-imino-5-pentan-3-yloxy-1,3-benzothiazol-6-yl)iminoazanium Traditional Name: [3-benzyl-5-(1-ethylpropoxy)-2-imino-1,3-benzothiazol-6-yl]iminoammonium Formula: C19H23N4OS+ MolecularWeight: 355.47712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1=CC2=C(C=C1N=[NH2+])SC(=N)N2CC3=CC=CC=C3

Isomeric SMILES

CCC(CC)OC1=CC2=C(C=C1N=[NH2+])SC(=N)N2CC3=CC=CC=C3

InChI

InChI=1S/C19H22N4OS/c1-3-14(4-2)24-17-11-16-18(10-15(17)22-21)25-19(20)23(16)12-13-8-6-5-7-9-13/h5-11,14,20-21H,3-4,12H2,1-2H3/p+1