[4-[(E)-(5-pentyl-1,3-thiazol-2-yl)iminomethyl]phenyl] 4-pentoxybenzoate

Systemtic Name: [4-[(E)-(5-pentyl-1,3-thiazol-2-yl)iminomethyl]phenyl] 4-pentoxybenzoate Openeye Name: [4-[(E)-(5-pentylthiazol-2-yl)iminomethyl]phenyl] 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid [4-[(E)-(5-pentyl-2-thiazolyl)iminomethyl]phenyl] ester IUPAC Name: [4-[(E)-(5-pentyl-1,3-thiazol-2-yl)iminomethyl]phenyl] 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid [4-[(E)-(5-amylthiazol-2-yl)iminomethyl]phenyl] ester Formula: C27H32N2O3S MolecularWeight: 464.61958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(S1)N=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCC

Isomeric SMILES

CCCCCC1=CN=C(S1)/N=C/C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCC

InChI

InChI=1S/C27H32N2O3S/c1-3-5-7-9-25-20-29-27(33-25)28-19-21-10-14-24(15-11-21)32-26(30)22-12-16-23(17-13-22)31-18-8-6-4-2/h10-17,19-20H,3-9,18H2,1-2H3/b28-19+