N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-(cyclopropylcarbonylamino)benzamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-(cyclopropylcarbonylamino)benzamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-(cyclopropanecarbonylamino)benzamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-3-[[cyclopropyl(oxo)methyl]amino]benzamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-(cyclopropanecarbonylamino)benzamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-3-(cyclopropanecarbonylamino)benzamide Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

InChI

InChI=1S/C21H21ClN4O3/c22-17-11-16(6-7-18(17)26-9-8-23-19(27)12-26)25-21(29)14-2-1-3-15(10-14)24-20(28)13-4-5-13/h1-3,6-7,10-11,13H,4-5,8-9,12H2,(H,23,27)(H,24,28)(H,25,29)