N-naphthalen-1-yl-2-[[5-(phenylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]butanamide

Systemtic Name: N-naphthalen-1-yl-2-[[5-(phenylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: 2-[(4-allyl-5-benzyl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-naphthyl)butanamide CAS Name: N-(1-naphthalenyl)-2-[[5-(phenylmethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: 2-[(5-benzyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-naphthalen-1-ylbutanamide Traditional Name: 2-[(4-allyl-5-benzyl-1,2,4-triazol-3-yl)thio]-N-(1-naphthyl)butyramide Formula: C26H26N4OS MolecularWeight: 442.57584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NN=C(N3CC=C)CC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NN=C(N3CC=C)CC4=CC=CC=C4

InChI

InChI=1S/C26H26N4OS/c1-3-17-30-24(18-19-11-6-5-7-12-19)28-29-26(30)32-23(4-2)25(31)27-22-16-10-14-20-13-8-9-15-21(20)22/h3,5-16,23H,1,4,17-18H2,2H3,(H,27,31)