9-methyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]carbazole-3-carboxamide

Systemtic Name: 9-methyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]carbazole-3-carboxamide Openeye Name: N-[[4-allyl-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-9-methyl-carbazole-3-carboxamide CAS Name: 9-methyl-N-[[5-[(3-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-3-carbazolecarboxamide IUPAC Name: 9-methyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]carbazole-3-carboxamide Traditional Name: N-[[4-allyl-5-[(3-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]-9-methyl-carbazole-3-carboxamide Formula: C28H27N5OS MolecularWeight: 481.61188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC4=C(C=C3)N(C5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC4=C(C=C3)N(C5=CC=CC=C54)C

InChI

InChI=1S/C28H27N5OS/c1-4-14-33-26(30-31-28(33)35-18-20-9-7-8-19(2)15-20)17-29-27(34)21-12-13-25-23(16-21)22-10-5-6-11-24(22)32(25)3/h4-13,15-16H,1,14,17-18H2,2-3H3,(H,29,34)