N-(3-azanylpropyl)-N-[1-[1-(3-methoxyphenyl)-5-oxidanylidene-4-(phenylmethyl)-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methyl-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[1-[1-(3-methoxyphenyl)-5-oxidanylidene-4-(phenylmethyl)-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methyl-benzamide Openeye Name: N-(3-aminopropyl)-N-[1-[4-benzyl-1-(3-methoxyphenyl)-5-oxo-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-(3-aminopropyl)-N-[1-[1-(3-methoxyphenyl)-5-oxo-4-(phenylmethyl)-1,2,4-triazol-3-yl]-2-methylpropyl]-4-methylbenzamide IUPAC Name: N-(3-aminopropyl)-N-[1-[4-benzyl-1-(3-methoxyphenyl)-5-oxo-1,2,4-triazol-3-yl]-2-methylpropyl]-4-methylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-[4-benzyl-5-keto-1-(3-methoxyphenyl)-1,2,4-triazol-3-yl]-2-methyl-propyl]-4-methyl-benzamide Formula: C31H37N5O3 MolecularWeight: 527.65718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NN(C(=O)N2CC3=CC=CC=C3)C4=CC(=CC=C4)OC)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NN(C(=O)N2CC3=CC=CC=C3)C4=CC(=CC=C4)OC)C(C)C

InChI

InChI=1S/C31H37N5O3/c1-22(2)28(34(19-9-18-32)30(37)25-16-14-23(3)15-17-25)29-33-36(26-12-8-13-27(20-26)39-4)31(38)35(29)21-24-10-6-5-7-11-24/h5-8,10-17,20,22,28H,9,18-19,21,32H2,1-4H3