N-[[5-butylsulfanyl-2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide

Systemtic Name: N-[[5-butylsulfanyl-2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide Openeye Name: N-[[5-butylsulfanyl-2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide CAS Name: N-[[5-(butylthio)-2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide IUPAC Name: N-[[5-butylsulfanyl-2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide Traditional Name: N-[5-(butylthio)-2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]benzyl]propionamide Formula: C24H30N4O3S MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC(=C(C=C1C2=NN=CN2C3=CC(=CC=C3)OC)OC)CNC(=O)CC

Isomeric SMILES

CCCCSC1=CC(=C(C=C1C2=NN=CN2C3=CC(=CC=C3)OC)OC)CNC(=O)CC

InChI

InChI=1S/C24H30N4O3S/c1-5-7-11-32-22-12-17(15-25-23(29)6-2)21(31-4)14-20(22)24-27-26-16-28(24)18-9-8-10-19(13-18)30-3/h8-10,12-14,16H,5-7,11,15H2,1-4H3,(H,25,29)