3-azanyl-4-[(phenylmethyl)amino]thiochromen-2-one

Systemtic Name: 3-azanyl-4-[(phenylmethyl)amino]thiochromen-2-one Openeye Name: 3-amino-4-(benzylamino)thiochromen-2-one CAS Name: 3-amino-4-[(phenylmethyl)amino]-1-benzothiopyran-2-one IUPAC Name: 3-amino-4-(benzylamino)thiochromen-2-one Traditional Name: 3-amino-4-(benzylamino)thiochromen-2-one Formula: C16H14N2OS MolecularWeight: 282.36016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=O)SC3=CC=CC=C32)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=O)SC3=CC=CC=C32)N

InChI

InChI=1S/C16H14N2OS/c17-14-15(18-10-11-6-2-1-3-7-11)12-8-4-5-9-13(12)20-16(14)19/h1-9,18H,10,17H2