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

Systemtic Name: 4-[1-azanyl-3-(2-morpholin-4-ylethylamino)-3-oxidanylidene-propyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-3-(2-morpholinoethylamino)-3-oxo-propyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-3-[2-(4-morpholinyl)ethylamino]-3-oxopropyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-3-(2-morpholin-4-ylethylamino)-3-oxopropyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-3-keto-3-(2-morpholinoethylamino)propyl]-N-(4-pyridyl)benzamide Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)CC(C2=CC=C(C=C2)C(=O)NC3=CC=NC=C3)N

Isomeric SMILES

C1COCCN1CCNC(=O)CC(C2=CC=C(C=C2)C(=O)NC3=CC=NC=C3)N

InChI

InChI=1S/C21H27N5O3/c22-19(15-20(27)24-9-10-26-11-13-29-14-12-26)16-1-3-17(4-2-16)21(28)25-18-5-7-23-8-6-18/h1-8,19H,9-15,22H2,(H,24,27)(H,23,25,28)