3-azanyl-1-butyl-4-[5-methoxy-2-[3-(1,2,4-triazol-1-yl)propoxy]phenyl]pyridin-2-one

Systemtic Name: 3-azanyl-1-butyl-4-[5-methoxy-2-[3-(1,2,4-triazol-1-yl)propoxy]phenyl]pyridin-2-one Openeye Name: 3-amino-1-butyl-4-[5-methoxy-2-[3-(1,2,4-triazol-1-yl)propoxy]phenyl]pyridin-2-one CAS Name: 3-amino-1-butyl-4-[5-methoxy-2-[3-(1,2,4-triazol-1-yl)propoxy]phenyl]-2-pyridinone IUPAC Name: 3-amino-1-butyl-4-[5-methoxy-2-[3-(1,2,4-triazol-1-yl)propoxy]phenyl]pyridin-2-one Traditional Name: 3-amino-1-butyl-4-[5-methoxy-2-[3-(1,2,4-triazol-1-yl)propoxy]phenyl]-2-pyridone Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC(=C(C1=O)N)C2=C(C=CC(=C2)OC)OCCCN3C=NC=N3

Isomeric SMILES

CCCCN1C=CC(=C(C1=O)N)C2=C(C=CC(=C2)OC)OCCCN3C=NC=N3

InChI

InChI=1S/C21H27N5O3/c1-3-4-9-25-11-8-17(20(22)21(25)27)18-13-16(28-2)6-7-19(18)29-12-5-10-26-15-23-14-24-26/h6-8,11,13-15H,3-5,9-10,12,22H2,1-2H3