N-[(2-methylphenyl)methyl]phenoxathiin-3-amine

Systemtic Name: N-[(2-methylphenyl)methyl]phenoxathiin-3-amine Openeye Name: N-(o-tolylmethyl)phenoxathiin-3-amine CAS Name: N-[(2-methylphenyl)methyl]-3-phenoxathiinamine IUPAC Name: N-[(2-methylphenyl)methyl]phenoxathiin-3-amine Traditional Name: (2-methylbenzyl)-phenoxathiin-3-yl-amine Formula: C20H17NOS MolecularWeight: 319.42008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC2=CC3=C(C=C2)SC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=CC=C1CNC2=CC3=C(C=C2)SC4=CC=CC=C4O3

InChI

InChI=1S/C20H17NOS/c1-14-6-2-3-7-15(14)13-21-16-10-11-20-18(12-16)22-17-8-4-5-9-19(17)23-20/h2-12,21H,13H2,1H3