[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(5-methylthiophen-2-yl)methyl]-phenethyl-azanium

Systemtic Name: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(5-methylthiophen-2-yl)methyl]-phenethyl-azanium Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl]-[(5-methyl-2-thienyl)methyl]-phenethyl-ammonium CAS Name: [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl]-[(5-methyl-2-thiophenyl)methyl]-phenethylammonium IUPAC Name: [2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]-[(5-methylthiophen-2-yl)methyl]-phenethylazanium Traditional Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl]-[(5-methyl-2-thienyl)methyl]-phenethyl-ammonium Formula: C21H24N3O2S2+ MolecularWeight: 414.56416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+](CCC2=CC=CC=C2)CC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

CC1=CC=C(S1)C[NH+](CCC2=CC=CC=C2)CC(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C21H23N3O2S2/c1-15-7-8-17(28-15)13-24(11-9-16-5-3-2-4-6-16)14-19(25)23-21-18(20(22)26)10-12-27-21/h2-8,10,12H,9,11,13-14H2,1H3,(H2,22,26)(H,23,25)/p+1