3-[(4-aminophenyl)methyl]-5-(4-ethoxy-3-methoxy-phenyl)-6H-1,3,4-thiadiazin-2-one

Systemtic Name: 3-[(4-aminophenyl)methyl]-5-(4-ethoxy-3-methoxy-phenyl)-6H-1,3,4-thiadiazin-2-one Openeye Name: 3-[(4-aminophenyl)methyl]-5-(4-ethoxy-3-methoxy-phenyl)-6H-1,3,4-thiadiazin-2-one CAS Name: 3-[(4-aminophenyl)methyl]-5-(4-ethoxy-3-methoxyphenyl)-6H-1,3,4-thiadiazin-2-one IUPAC Name: 3-[(4-aminophenyl)methyl]-5-(4-ethoxy-3-methoxyphenyl)-6H-1,3,4-thiadiazin-2-one Traditional Name: 3-(4-aminobenzyl)-5-(4-ethoxy-3-methoxy-phenyl)-6H-1,3,4-thiadiazin-2-one Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C(=O)SC2)CC3=CC=C(C=C3)N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C(=O)SC2)CC3=CC=C(C=C3)N)OC

InChI

InChI=1S/C19H21N3O3S/c1-3-25-17-9-6-14(10-18(17)24-2)16-12-26-19(23)22(21-16)11-13-4-7-15(20)8-5-13/h4-10H,3,11-12,20H2,1-2H3