N-cyclopropyl-4-[(E)-3-oxidanylidene-3-[[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]amino]prop-1-enyl]benzamide

Systemtic Name: N-cyclopropyl-4-[(E)-3-oxidanylidene-3-[[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]amino]prop-1-enyl]benzamide Openeye Name: N-cyclopropyl-4-[(E)-3-oxo-3-[[6-(3-oxopiperazin-1-yl)-3-pyridyl]amino]prop-1-enyl]benzamide CAS Name: N-cyclopropyl-4-[(E)-3-oxo-3-[[6-(3-oxo-1-piperazinyl)-3-pyridinyl]amino]prop-1-enyl]benzamide IUPAC Name: N-cyclopropyl-4-[(E)-3-oxo-3-[[6-(3-oxopiperazin-1-yl)pyridin-3-yl]amino]prop-1-enyl]benzamide Traditional Name: N-cyclopropyl-4-[(E)-3-keto-3-[[6-(3-ketopiperazino)-3-pyridyl]amino]prop-1-enyl]benzamide Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=C(C=C2)C=CC(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

C1CC1NC(=O)C2=CC=C(C=C2)/C=C/C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C22H23N5O3/c28-20(10-3-15-1-4-16(5-2-15)22(30)26-17-6-7-17)25-18-8-9-19(24-13-18)27-12-11-23-21(29)14-27/h1-5,8-10,13,17H,6-7,11-12,14H2,(H,23,29)(H,25,28)(H,26,30)/b10-3+