N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-phenyl-propanamide

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-phenyl-propanamide Openeye Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-phenyl-propanamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-phenylpropanamide IUPAC Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-phenylpropanamide Traditional Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-phenyl-propionamide Formula: C22H19ClN2O2S MolecularWeight: 410.91646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H19ClN2O2S/c1-15-18(23)10-11-19-21(15)24-22(28-19)25(14-17-8-5-13-27-17)20(26)12-9-16-6-3-2-4-7-16/h2-8,10-11,13H,9,12,14H2,1H3