13-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane

Systemtic Name: 13-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane Openeye Name: 13-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane CAS Name: 13-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane IUPAC Name: 13-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane Traditional Name: 13-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4CCOCCOCCOCCOCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4CCOCCOCCOCCOCC4

InChI

InChI=1S/C24H30N2O4S/c1-19-2-7-22-23(18-19)31-24(25-22)20-3-5-21(6-4-20)26-8-10-27-12-14-29-16-17-30-15-13-28-11-9-26/h2-7,18H,8-17H2,1H3