3-bromanyl-4-ethoxy-5-methoxy-N-[(1R)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-5-methoxy-N-[(1R)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Openeye Name: 3-bromo-4-ethoxy-5-methoxy-N-[(1R)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide CAS Name: 3-bromo-4-ethoxy-5-methoxy-N-[(1R)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-5-methoxy-N-[(1R)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Traditional Name: 3-bromo-4-ethoxy-5-methoxy-N-[(1R)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Formula: C20H21BrN4O3 MolecularWeight: 445.30974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NC(C)C2=CC=C(C=C2)N3C=NC=N3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)N[C@H](C)C2=CC=C(C=C2)N3C=NC=N3)OC

InChI

InChI=1S/C20H21BrN4O3/c1-4-28-19-17(21)9-15(10-18(19)27-3)20(26)24-13(2)14-5-7-16(8-6-14)25-12-22-11-23-25/h5-13H,4H2,1-3H3,(H,24,26)/t13-/m1/s1