N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide

Systemtic Name: N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide Openeye Name: N-[4-(3-bromophenyl)thiazol-2-yl]-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: N-[4-(3-bromophenyl)-2-thiazolyl]-3-(4-hexoxy-3-methoxyphenyl)-2-propenamide IUPAC Name: N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(4-hexoxy-3-methoxyphenyl)prop-2-enamide Traditional Name: N-[4-(3-bromophenyl)thiazol-2-yl]-3-(4-hexoxy-3-methoxy-phenyl)acrylamide Formula: C25H27BrN2O3S MolecularWeight: 515.46248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C25H27BrN2O3S/c1-3-4-5-6-14-31-22-12-10-18(15-23(22)30-2)11-13-24(29)28-25-27-21(17-32-25)19-8-7-9-20(26)16-19/h7-13,15-17H,3-6,14H2,1-2H3,(H,27,28,29)