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

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-4-[(4-methoxyphenyl)thio]butyramide Formula: C25H26N2O3S2 MolecularWeight: 466.61554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CO3)C(=O)CCCSC4=CC=C(C=C4)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CO3)C(=O)CCCSC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H26N2O3S2/c1-3-18-8-13-22-23(16-18)32-25(26-22)27(17-20-6-4-14-30-20)24(28)7-5-15-31-21-11-9-19(29-2)10-12-21/h4,6,8-14,16H,3,5,7,15,17H2,1-2H3