4-chloranyl-N-[1-[5-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: 4-chloranyl-N-[1-[5-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[1-[4-allyl-5-[2-(2-naphthyl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethyl]-4-chloro-benzamide CAS Name: 4-chloro-N-[1-[5-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 4-chloro-N-[1-[5-(2-naphthalen-2-yl-2-oxoethyl)sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: N-[1-[4-allyl-5-[[2-keto-2-(2-naphthyl)ethyl]thio]-1,2,4-triazol-3-yl]ethyl]-4-chloro-benzamide Formula: C26H23ClN4O2S MolecularWeight: 491.00442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1CC=C)SCC(=O)C2=CC3=CC=CC=C3C=C2)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C1=NN=C(N1CC=C)SCC(=O)C2=CC3=CC=CC=C3C=C2)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H23ClN4O2S/c1-3-14-31-24(17(2)28-25(33)19-10-12-22(27)13-11-19)29-30-26(31)34-16-23(32)21-9-8-18-6-4-5-7-20(18)15-21/h3-13,15,17H,1,14,16H2,2H3,(H,28,33)