[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-(1,3-benzothiazol-2-ylmethyl)-methyl-azanium

Systemtic Name: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-(1,3-benzothiazol-2-ylmethyl)-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C16H17N4O2S2+ MolecularWeight: 361.46178

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C16H16N4O2S2/c1-20(9-14-18-11-4-2-3-5-12(11)24-14)8-13(21)19-16-10(15(17)22)6-7-23-16/h2-7H,8-9H2,1H3,(H2,17,22)(H,19,21)/p+1