N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-9H-xanthene-9-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-9H-xanthene-9-carboxamide Openeye Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-9H-xanthene-9-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-9H-xanthene-9-carboxamide IUPAC Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-9H-xanthene-9-carboxamide Traditional Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-9H-xanthene-9-carboxamide Formula: C30H24N2O2S MolecularWeight: 476.58876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46)C

InChI

InChI=1S/C30H24N2O2S/c1-19-16-20(2)28-26(17-19)35-30(31-28)32(18-21-10-4-3-5-11-21)29(33)27-22-12-6-8-14-24(22)34-25-15-9-7-13-23(25)27/h3-17,27H,18H2,1-2H3