methyl 4-[ethyl-[(4-phenylmethoxy-1,2,5-thiadiazol-3-yl)methyl]amino]benzoate

Systemtic Name: methyl 4-[ethyl-[(4-phenylmethoxy-1,2,5-thiadiazol-3-yl)methyl]amino]benzoate Openeye Name: methyl 4-[(4-benzyloxy-1,2,5-thiadiazol-3-yl)methyl-ethyl-amino]benzoate CAS Name: 4-[ethyl-[(4-phenylmethoxy-1,2,5-thiadiazol-3-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[ethyl-[(4-phenylmethoxy-1,2,5-thiadiazol-3-yl)methyl]amino]benzoate Traditional Name: 4-[(4-benzoxy-1,2,5-thiadiazol-3-yl)methyl-ethyl-amino]benzoic acid methyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NSN=C1OCC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN(CC1=NSN=C1OCC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H21N3O3S/c1-3-23(17-11-9-16(10-12-17)20(24)25-2)13-18-19(22-27-21-18)26-14-15-7-5-4-6-8-15/h4-12H,3,13-14H2,1-2H3