N-[2-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide

Systemtic Name: N-[2-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide Openeye Name: N-[2-[2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide CAS Name: N-[2-[[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]propanamide IUPAC Name: N-[2-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide Traditional Name: N-[2-[[2-keto-2-(p-anisylamino)ethyl]thio]-1,3-benzothiazol-6-yl]propionamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N3O3S2/c1-3-18(24)22-14-6-9-16-17(10-14)28-20(23-16)27-12-19(25)21-11-13-4-7-15(26-2)8-5-13/h4-10H,3,11-12H2,1-2H3,(H,21,25)(H,22,24)