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

Systemtic Name: N-[(3-chlorophenyl)methylsulfanyl]-N-[[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide Openeye Name: N-[(3-chlorophenyl)methylsulfanyl]-N-[[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide CAS Name: N-[(3-chlorophenyl)methylthio]-N-[[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide IUPAC Name: N-[(3-chlorophenyl)methylsulfanyl]-N-[[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide Traditional Name: N-[(3-chlorobenzyl)thio]-N-[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]benzyl]propionamide Formula: C27H27ClN4O3S MolecularWeight: 523.04628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1=C(C=C(C=C1)C2=NN=CN2C3=CC(=CC=C3)OC)OC)SCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCC(=O)N(CC1=C(C=C(C=C1)C2=NN=CN2C3=CC(=CC=C3)OC)OC)SCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C27H27ClN4O3S/c1-4-26(33)32(36-17-19-7-5-8-22(28)13-19)16-21-12-11-20(14-25(21)35-3)27-30-29-18-31(27)23-9-6-10-24(15-23)34-2/h5-15,18H,4,16-17H2,1-3H3