2-[4-(1,4,7-trithia-10-azacyclododec-10-yl)phenyl]-1,3-benzothiazole

Systemtic Name: 2-[4-(1,4,7-trithia-10-azacyclododec-10-yl)phenyl]-1,3-benzothiazole Openeye Name: 2-[4-(1,4,7-trithia-10-azacyclododec-10-yl)phenyl]-1,3-benzothiazole CAS Name: 2-[4-(1,4,7-trithia-10-azacyclododec-10-yl)phenyl]-1,3-benzothiazole IUPAC Name: 2-[4-(1,4,7-trithia-10-azacyclododec-10-yl)phenyl]-1,3-benzothiazole Traditional Name: 2-[4-(1,4,7-trithia-10-azacyclododec-10-yl)phenyl]-1,3-benzothiazole Formula: C21H24N2S4 MolecularWeight: 432.68866

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCSCCSCCN1C2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CSCCSCCSCCN1C2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H24N2S4/c1-2-4-20-19(3-1)22-21(27-20)17-5-7-18(8-6-17)23-9-11-24-13-15-26-16-14-25-12-10-23/h1-8H,9-16H2