N-[2-[5-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-4-methoxy-benzamide

Systemtic Name: N-[2-[5-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-4-methoxy-benzamide Openeye Name: N-[2-[5-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-4-methoxy-benzamide CAS Name: N-[2-[5-[[2-(3-chloro-4-methylanilino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-4-methoxybenzamide IUPAC Name: N-[2-[5-[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-4-methoxybenzamide Traditional Name: N-[2-[5-[[2-(3-chloro-4-methyl-anilino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-4-methoxy-benzamide Formula: C22H24ClN5O3S MolecularWeight: 473.97566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)CCNC(=O)C3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)CCNC(=O)C3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C22H24ClN5O3S/c1-14-4-7-16(12-18(14)23)25-20(29)13-32-22-27-26-19(28(22)2)10-11-24-21(30)15-5-8-17(31-3)9-6-15/h4-9,12H,10-11,13H2,1-3H3,(H,24,30)(H,25,29)