[2-[bis(prop-2-enyl)amino]-5-octoxy-1,3-benzothiazol-6-yl]iminoazanium

Systemtic Name: [2-[bis(prop-2-enyl)amino]-5-octoxy-1,3-benzothiazol-6-yl]iminoazanium Openeye Name: [2-(diallylamino)-5-octoxy-1,3-benzothiazol-6-yl]iminoammonium CAS Name: [2-[bis(prop-2-enyl)amino]-5-octoxy-1,3-benzothiazol-6-yl]iminoammonium IUPAC Name: [2-[bis(prop-2-enyl)amino]-5-octoxy-1,3-benzothiazol-6-yl]iminoazanium Traditional Name: [2-(diallylamino)-5-octoxy-1,3-benzothiazol-6-yl]iminoammonium Formula: C21H31N4OS+ MolecularWeight: 387.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C2C(=C1)N=C(S2)N(CC=C)CC=C)N=[NH2+]

Isomeric SMILES

CCCCCCCCOC1=C(C=C2C(=C1)N=C(S2)N(CC=C)CC=C)N=[NH2+]

InChI

InChI=1S/C21H30N4OS/c1-4-7-8-9-10-11-14-26-19-15-18-20(16-17(19)24-22)27-21(23-18)25(12-5-2)13-6-3/h5-6,15-16,22H,2-4,7-14H2,1H3/p+1