N1-hexadecyl-N4-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzene-1,4-disulfonamide

Systemtic Name: N1-hexadecyl-N4-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzene-1,4-disulfonamide Openeye Name: N1-hexadecyl-N4-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzene-1,4-disulfonamide CAS Name: N1-hexadecyl-N4-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzene-1,4-disulfonamide IUPAC Name: 1-N-hexadecyl-4-N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzene-1,4-disulfonamide Traditional Name: N-cetyl-N'-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]benzene-1,4-disulfonamide Formula: C30H46N4O4S3 MolecularWeight: 622.90564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NN=C2N(C3=CC=CC=C3S2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N/N=C\2/N(C3=CC=CC=C3S2)C

InChI

InChI=1S/C30H46N4O4S3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-25-31-40(35,36)26-21-23-27(24-22-26)41(37,38)33-32-30-34(2)28-19-16-17-20-29(28)39-30/h16-17,19-24,31,33H,3-15,18,25H2,1-2H3/b32-30-