4-[[5-azanyl-1-(5-methylthiophen-2-yl)carbonyl-1,2,4-triazol-3-yl]amino]-N-(2-dimethylaminoethyl)benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-1-(5-methylthiophen-2-yl)carbonyl-1,2,4-triazol-3-yl]amino]-N-(2-dimethylaminoethyl)benzenesulfonamide Openeye Name: 4-[[5-amino-1-(5-methylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]-N-(2-dimethylaminoethyl)benzenesulfonamide CAS Name: 4-[[5-amino-1-[(5-methyl-2-thiophenyl)-oxomethyl]-1,2,4-triazol-3-yl]amino]-N-(2-dimethylaminoethyl)benzenesulfonamide IUPAC Name: 4-[[5-amino-1-(5-methylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]-N-(2-dimethylaminoethyl)benzenesulfonamide Traditional Name: 4-[[5-amino-1-(5-methylthiophene-2-carbonyl)-1,2,4-triazol-3-yl]amino]-N-(2-dimethylaminoethyl)benzenesulfonamide Formula: C18H23N7O3S2 MolecularWeight: 449.55032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)NCCN(C)C)N

Isomeric SMILES

CC1=CC=C(S1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)NCCN(C)C)N

InChI

InChI=1S/C18H23N7O3S2/c1-12-4-9-15(29-12)16(26)25-17(19)22-18(23-25)21-13-5-7-14(8-6-13)30(27,28)20-10-11-24(2)3/h4-9,20H,10-11H2,1-3H3,(H3,19,21,22,23)