benzotriazol-1-yl 6-[5-[4-(6-methoxyhexoxy)phenyl]-1,3,4-thiadiazol-2-yl]naphthalene-2-carboxylate

Systemtic Name: benzotriazol-1-yl 6-[5-[4-(6-methoxyhexoxy)phenyl]-1,3,4-thiadiazol-2-yl]naphthalene-2-carboxylate Openeye Name: benzotriazol-1-yl 6-[5-[4-(6-methoxyhexoxy)phenyl]-1,3,4-thiadiazol-2-yl]naphthalene-2-carboxylate CAS Name: 6-[5-[4-(6-methoxyhexoxy)phenyl]-1,3,4-thiadiazol-2-yl]-2-naphthalenecarboxylic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 6-[5-[4-(6-methoxyhexoxy)phenyl]-1,3,4-thiadiazol-2-yl]naphthalene-2-carboxylate Traditional Name: 6-[5-[4-(6-methoxyhexoxy)phenyl]-1,3,4-thiadiazol-2-yl]naphthalene-2-carboxylic acid benzotriazol-1-yl ester Formula: C32H29N5O4S MolecularWeight: 579.66876

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCCOC1=CC=C(C=C1)C2=NN=C(S2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)ON5C6=CC=CC=C6N=N5

Isomeric SMILES

COCCCCCCOC1=CC=C(C=C1)C2=NN=C(S2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)ON5C6=CC=CC=C6N=N5

InChI

InChI=1S/C32H29N5O4S/c1-39-18-6-2-3-7-19-40-27-16-14-22(15-17-27)30-34-35-31(42-30)25-12-10-24-21-26(13-11-23(24)20-25)32(38)41-37-29-9-5-4-8-28(29)33-36-37/h4-5,8-17,20-21H,2-3,6-7,18-19H2,1H3