4-[1-azanyl-3-(3-methylbutan-2-ylamino)-3-oxidanylidene-propyl]-N-pyridin-4-yl-benzamide

Systemtic Name: 4-[1-azanyl-3-(3-methylbutan-2-ylamino)-3-oxidanylidene-propyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-3-(1,2-dimethylpropylamino)-3-oxo-propyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-3-(3-methylbutan-2-ylamino)-3-oxopropyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-3-(3-methylbutan-2-ylamino)-3-oxopropyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-3-(1,2-dimethylpropylamino)-3-keto-propyl]-N-(4-pyridyl)benzamide Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CC(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N

Isomeric SMILES

CC(C)C(C)NC(=O)CC(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N

InChI

InChI=1S/C20H26N4O2/c1-13(2)14(3)23-19(25)12-18(21)15-4-6-16(7-5-15)20(26)24-17-8-10-22-11-9-17/h4-11,13-14,18H,12,21H2,1-3H3,(H,23,25)(H,22,24,26)