N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-[(4-methoxyphenyl)thio]propionamide Formula: C24H24N2O3S2 MolecularWeight: 452.58896

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CO3)C(=O)CCSC4=CC=C(C=C4)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CO3)C(=O)CCSC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H24N2O3S2/c1-3-17-6-11-21-22(15-17)31-24(25-21)26(16-19-5-4-13-29-19)23(27)12-14-30-20-9-7-18(28-2)8-10-20/h4-11,13,15H,3,12,14,16H2,1-2H3