3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-[(5-chloranylthiophen-2-yl)methyl]-N-ethyl-propanamide

Systemtic Name: 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-[(5-chloranylthiophen-2-yl)methyl]-N-ethyl-propanamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-ethyl-propanamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-ethylpropanamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-ethylpropanamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-ethyl-propionamide Formula: C17H18ClN3O3S2 MolecularWeight: 411.92612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)C(=O)CCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)C(=O)CCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H18ClN3O3S2/c1-2-21(11-12-7-8-15(18)25-12)16(22)9-10-19-17-13-5-3-4-6-14(13)26(23,24)20-17/h3-8H,2,9-11H2,1H3,(H,19,20)