2-[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-phenyl-benzamide

Systemtic Name: 2-[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-phenyl-benzamide Openeye Name: 2-[[2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-phenyl-benzamide CAS Name: 2-[[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-phenylbenzamide Traditional Name: 2-[[2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-phenyl-benzamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N5O2S/c1-3-13-26-15(2)24-25-21(26)29-14-19(27)23-18-12-8-7-11-17(18)20(28)22-16-9-5-4-6-10-16/h3-12H,1,13-14H2,2H3,(H,22,28)(H,23,27)