3-(5-bromanylindol-1-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]propanamide

Systemtic Name: 3-(5-bromanylindol-1-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]propanamide Openeye Name: 3-(5-bromoindol-1-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]propanamide CAS Name: 3-(5-bromo-1-indolyl)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]propanamide IUPAC Name: 3-(5-bromoindol-1-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]propanamide Traditional Name: 3-(5-bromoindol-1-yl)-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]propionamide Formula: C20H18BrN5O MolecularWeight: 424.29382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC=N2)NC(=O)CCN3C=CC4=C3C=CC(=C4)Br

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC=N2)NC(=O)CCN3C=CC4=C3C=CC(=C4)Br

InChI

InChI=1S/C20H18BrN5O/c21-17-3-6-19-16(11-17)7-9-25(19)10-8-20(27)24-18-4-1-15(2-5-18)12-26-14-22-13-23-26/h1-7,9,11,13-14H,8,10,12H2,(H,24,27)