N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(5,6-dimethyl-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:

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CO3)C(=O)CCSC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CO3)C(=O)CCSC4=CC=C(C=C4)OC

InChI

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