N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfanyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfanyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)propanamide Openeye Name: N-(2-furylmethyl)-N-(4-isopropyl-1,3-benzothiazol-2-yl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(2-furanylmethyl)-3-[(4-methylphenyl)thio]-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: N-(furan-2-ylmethyl)-3-(4-methylphenyl)sulfanyl-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(2-furfuryl)-N-(4-isopropyl-1,3-benzothiazol-2-yl)-3-(p-tolylthio)propionamide Formula: C25H26N2O2S2 MolecularWeight: 450.61614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)N(CC2=CC=CO2)C3=NC4=C(C=CC=C4S3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)N(CC2=CC=CO2)C3=NC4=C(C=CC=C4S3)C(C)C

InChI

InChI=1S/C25H26N2O2S2/c1-17(2)21-7-4-8-22-24(21)26-25(31-22)27(16-19-6-5-14-29-19)23(28)13-15-30-20-11-9-18(3)10-12-20/h4-12,14,17H,13,15-16H2,1-3H3