N-[2-(2-oxidanylidenepropylsulfanyl)-1,3-benzothiazol-6-yl]naphthalene-1-carboxamide

Systemtic Name: N-[2-(2-oxidanylidenepropylsulfanyl)-1,3-benzothiazol-6-yl]naphthalene-1-carboxamide Openeye Name: N-(2-acetonylsulfanyl-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide CAS Name: N-[2-(2-oxopropylthio)-1,3-benzothiazol-6-yl]-1-naphthalenecarboxamide IUPAC Name: N-[2-(2-oxopropylsulfanyl)-1,3-benzothiazol-6-yl]naphthalene-1-carboxamide Traditional Name: N-[2-(acetonylthio)-1,3-benzothiazol-6-yl]-1-naphthamide Formula: C21H16N2O2S2 MolecularWeight: 392.49394

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H16N2O2S2/c1-13(24)12-26-21-23-18-10-9-15(11-19(18)27-21)22-20(25)17-8-4-6-14-5-2-3-7-16(14)17/h2-11H,12H2,1H3,(H,22,25)