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

Systemtic Name: N-[1-[5-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-oxidanyl-ethyl]-4-methoxy-benzamide Openeye Name: N-[1-[4-allyl-5-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-4-methoxy-benzamide CAS Name: N-[1-[5-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-hydroxyethyl]-4-methoxybenzamide IUPAC Name: N-[1-[5-[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-2-hydroxyethyl]-4-methoxybenzamide Traditional Name: N-[1-[4-allyl-5-[[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-4-methoxy-benzamide Formula: C24H26ClN5O4S MolecularWeight: 516.01234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CSC2=NN=C(N2CC=C)C(CO)NC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CSC2=NN=C(N2CC=C)C(CO)NC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H26ClN5O4S/c1-4-12-30-22(20(13-31)27-23(33)16-8-10-17(34-3)11-9-16)28-29-24(30)35-14-21(32)26-19-7-5-6-18(25)15(19)2/h4-11,20,31H,1,12-14H2,2-3H3,(H,26,32)(H,27,33)