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

Systemtic Name: 3-[(4-aminophenyl)methyl]-5-(3-cyclopentyloxy-4-methoxy-phenyl)-6H-1,3,4-thiadiazin-2-one Openeye Name: 3-[(4-aminophenyl)methyl]-5-[3-(cyclopentoxy)-4-methoxy-phenyl]-6H-1,3,4-thiadiazin-2-one CAS Name: 3-[(4-aminophenyl)methyl]-5-(3-cyclopentyloxy-4-methoxyphenyl)-6H-1,3,4-thiadiazin-2-one IUPAC Name: 3-[(4-aminophenyl)methyl]-5-(3-cyclopentyloxy-4-methoxyphenyl)-6H-1,3,4-thiadiazin-2-one Traditional Name: 3-(4-aminobenzyl)-5-[3-(cyclopentoxy)-4-methoxy-phenyl]-6H-1,3,4-thiadiazin-2-one Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)SC2)CC3=CC=C(C=C3)N)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)SC2)CC3=CC=C(C=C3)N)OC4CCCC4

InChI

InChI=1S/C22H25N3O3S/c1-27-20-11-8-16(12-21(20)28-18-4-2-3-5-18)19-14-29-22(26)25(24-19)13-15-6-9-17(23)10-7-15/h6-12,18H,2-5,13-14,23H2,1H3