N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-4-phenylsulfanyl-butanamide Openeye Name: N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-4-phenylsulfanyl-butanamide CAS Name: N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-4-(phenylthio)butanamide IUPAC Name: N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-4-phenylsulfanylbutanamide Traditional Name: N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-4-(phenylthio)butyramide Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C3C(=C2)N=C(S3)NC(=O)CCCSC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C3C(=C2)N=C(S3)NC(=O)CCCSC4=CC=CC=C4

InChI

InChI=1S/C18H16N2O3S2/c21-17(7-4-8-24-12-5-2-1-3-6-12)20-18-19-13-9-14-15(23-11-22-14)10-16(13)25-18/h1-3,5-6,9-10H,4,7-8,11H2,(H,19,20,21)