[5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methyl-diethyl-azanium

Systemtic Name: [5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methyl-diethyl-azanium Openeye Name: [5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methyl-diethyl-ammonium CAS Name: [5-[(1Z)-1-(1,3-benzothiazol-2-ylhydrazinylidene)ethyl]-2-methoxyphenyl]methyl-diethylammonium IUPAC Name: [5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methylcarbonimidoyl]-2-methoxyphenyl]methyl-diethylazanium Traditional Name: [5-[(Z)-N-(1,3-benzothiazol-2-ylamino)-C-methyl-carbonimidoyl]-2-methoxy-benzyl]-diethyl-ammonium Formula: C21H27N4OS+ MolecularWeight: 383.53028

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC(=C1)C(=NNC2=NC3=CC=CC=C3S2)C)OC

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC(=C1)/C(=N\NC2=NC3=CC=CC=C3S2)/C)OC

InChI

InChI=1S/C21H26N4OS/c1-5-25(6-2)14-17-13-16(11-12-19(17)26-4)15(3)23-24-21-22-18-9-7-8-10-20(18)27-21/h7-13H,5-6,14H2,1-4H3,(H,22,24)/p+1/b23-15-