3-[(3-aminophenyl)methyl]-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one

Systemtic Name: 3-[(3-aminophenyl)methyl]-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one Openeye Name: 3-[(3-aminophenyl)methyl]-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one CAS Name: 3-[(3-aminophenyl)methyl]-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one IUPAC Name: 3-[(3-aminophenyl)methyl]-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one Traditional Name: 3-(3-aminobenzyl)-5-(3,4-dimethoxyphenyl)-6-ethyl-6H-1,3,4-thiadiazin-2-one Formula: C20H23N3O3S MolecularWeight: 385.47992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=NN(C(=O)S1)CC2=CC(=CC=C2)N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1C(=NN(C(=O)S1)CC2=CC(=CC=C2)N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H23N3O3S/c1-4-18-19(14-8-9-16(25-2)17(11-14)26-3)22-23(20(24)27-18)12-13-6-5-7-15(21)10-13/h5-11,18H,4,12,21H2,1-3H3