N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[(4S)-chroman-4-yl]-2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-2-(2,4-dimethylphenyl)-5-methyl-4-triazolecarboxamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-(2,4-dimethylphenyl)-5-methyltriazole-4-carboxamide Traditional Name: N-[(4S)-chroman-4-yl]-2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3CCOC4=CC=CC=C34)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)N[C@H]3CCOC4=CC=CC=C34)C)C

InChI

InChI=1S/C21H22N4O2/c1-13-8-9-18(14(2)12-13)25-23-15(3)20(24-25)21(26)22-17-10-11-27-19-7-5-4-6-16(17)19/h4-9,12,17H,10-11H2,1-3H3,(H,22,26)/t17-/m0/s1