4-(1,3-benzothiazol-2-yl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]butyramide Formula: C20H18N4OS2 MolecularWeight: 394.51312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=CC=CC(=C3)N4C=CNC4=S

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=CC=CC(=C3)N4C=CNC4=S

InChI

InChI=1S/C20H18N4OS2/c25-18(9-4-10-19-23-16-7-1-2-8-17(16)27-19)22-14-5-3-6-15(13-14)24-12-11-21-20(24)26/h1-3,5-8,11-13H,4,9-10H2,(H,21,26)(H,22,25)