3-(3-methoxy-4-pentoxy-phenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: 3-(3-methoxy-4-pentoxy-phenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: 3-(3-methoxy-4-pentoxy-phenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: 3-(3-methoxy-4-pentoxyphenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: 3-(3-methoxy-4-pentoxyphenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: 3-(4-amoxy-3-methoxy-phenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acrylamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=NC3=C(S2)CCCC3)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=NC3=C(S2)CCCC3)OC

InChI

InChI=1S/C22H28N2O3S/c1-3-4-7-14-27-18-12-10-16(15-19(18)26-2)11-13-21(25)24-22-23-17-8-5-6-9-20(17)28-22/h10-13,15H,3-9,14H2,1-2H3,(H,23,24,25)