2-[(E)-4-(5-azido-1,3-dioxan-2-yl)-2-methyl-but-2-enyl]sulfanyl-1,3-benzothiazole

Systemtic Name: 2-[(E)-4-(5-azido-1,3-dioxan-2-yl)-2-methyl-but-2-enyl]sulfanyl-1,3-benzothiazole Openeye Name: 2-[(E)-4-(5-azido-1,3-dioxan-2-yl)-2-methyl-but-2-enyl]sulfanyl-1,3-benzothiazole CAS Name: 2-[[(E)-4-(5-azido-1,3-dioxan-2-yl)-2-methylbut-2-enyl]thio]-1,3-benzothiazole IUPAC Name: 2-[(E)-4-(5-azido-1,3-dioxan-2-yl)-2-methylbut-2-enyl]sulfanyl-1,3-benzothiazole Traditional Name: 2-[[(E)-4-(5-azido-1,3-dioxan-2-yl)-2-methyl-but-2-enyl]thio]-1,3-benzothiazole Formula: C16H18N4O2S2 MolecularWeight: 362.46972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1OCC(CO1)N=[N+]=[N-])CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C/C(=C\CC1OCC(CO1)N=[N+]=[N-])/CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H18N4O2S2/c1-11(6-7-15-21-8-12(9-22-15)19-20-17)10-23-16-18-13-4-2-3-5-14(13)24-16/h2-6,12,15H,7-10H2,1H3/b11-6+