N-benzo[e][1,3]benzothiazol-2-yl-3-(4-ethanoyl-5-methyl-furan-2-yl)propanamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-3-(4-ethanoyl-5-methyl-furan-2-yl)propanamide Openeye Name: 3-(4-acetyl-5-methyl-2-furyl)-N-benzo[e][1,3]benzothiazol-2-yl-propanamide CAS Name: 3-(4-acetyl-5-methyl-2-furanyl)-N-(2-benzo[e][1,3]benzothiazolyl)propanamide IUPAC Name: 3-(4-acetyl-5-methylfuran-2-yl)-N-benzo[e][1,3]benzothiazol-2-ylpropanamide Traditional Name: 3-(4-acetyl-5-methyl-2-furyl)-N-benzo[e][1,3]benzothiazol-2-yl-propionamide Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CCC(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)C(=O)C

Isomeric SMILES

CC1=C(C=C(O1)CCC(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)C(=O)C

InChI

InChI=1S/C21H18N2O3S/c1-12(24)17-11-15(26-13(17)2)8-10-19(25)22-21-23-20-16-6-4-3-5-14(16)7-9-18(20)27-21/h3-7,9,11H,8,10H2,1-2H3,(H,22,23,25)