N,N'-bis[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]decanediamide

Systemtic Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]decanediamide Openeye Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]decanediamide CAS Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]decanediamide IUPAC Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]decanediamide Traditional Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]sebacamide Formula: C30H28N6O2S4 MolecularWeight: 632.84232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)NC(=O)CCCCCCCCC(=O)NC4=NC(=CS4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)NC(=O)CCCCCCCCC(=O)NC4=NC(=CS4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C30H28N6O2S4/c37-25(35-29-33-21(17-39-29)27-31-19-11-7-9-13-23(19)41-27)15-5-3-1-2-4-6-16-26(38)36-30-34-22(18-40-30)28-32-20-12-8-10-14-24(20)42-28/h7-14,17-18H,1-6,15-16H2,(H,33,35,37)(H,34,36,38)