9-(2-isothiocyanatophenyl)-N-methyl-6-methylimino-xanthen-3-amine

Systemtic Name: 9-(2-isothiocyanatophenyl)-N-methyl-6-methylimino-xanthen-3-amine Openeye Name: 9-(2-isothiocyanatophenyl)-N-methyl-6-methylimino-xanthen-3-amine CAS Name: 9-(2-isothiocyanatophenyl)-N-methyl-6-methylimino-3-xanthenamine IUPAC Name: 9-(2-isothiocyanatophenyl)-N-methyl-6-methyliminoxanthen-3-amine Traditional Name: [9-(2-isothiocyanatophenyl)-6-methylimino-xanthen-3-yl]-methyl-amine Formula: C22H17N3OS MolecularWeight: 371.45488

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC2=C(C=C1)C(=C3C=CC(=NC)C=C3O2)C4=CC=CC=C4N=C=S

Isomeric SMILES

CNC1=CC2=C(C=C1)C(=C3C=CC(=NC)C=C3O2)C4=CC=CC=C4N=C=S

InChI

InChI=1S/C22H17N3OS/c1-23-14-7-9-17-20(11-14)26-21-12-15(24-2)8-10-18(21)22(17)16-5-3-4-6-19(16)25-13-27/h3-12,23H,1-2H3