[4-[(4,5-dithiophen-2-yl-1,3-thiazol-2-yl)carbamoyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[(4,5-dithiophen-2-yl-1,3-thiazol-2-yl)carbamoyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[4,5-bis(2-thienyl)thiazol-2-yl]carbamoyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[(4,5-dithiophen-2-yl-2-thiazolyl)amino]-oxomethyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[(4,5-dithiophen-2-yl-1,3-thiazol-2-yl)carbamoyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[4,5-bis(2-thienyl)thiazol-2-yl]carbamoyl]benzyl]-dimethyl-ammonium Formula: C21H20N3OS3+ MolecularWeight: 426.598

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)C(=O)NC2=NC(=C(S2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)C(=O)NC2=NC(=C(S2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C21H19N3OS3/c1-24(2)13-14-7-9-15(10-8-14)20(25)23-21-22-18(16-5-3-11-26-16)19(28-21)17-6-4-12-27-17/h3-12H,13H2,1-2H3,(H,22,23,25)/p+1