N-[4-[2-azanyl-9-(trifluoromethyl)-3H-1,4-benzodiazepin-5-yl]phenyl]propanamide

Systemtic Name: N-[4-[2-azanyl-9-(trifluoromethyl)-3H-1,4-benzodiazepin-5-yl]phenyl]propanamide Openeye Name: N-[4-[2-amino-9-(trifluoromethyl)-3H-1,4-benzodiazepin-5-yl]phenyl]propanamide CAS Name: N-[4-[2-amino-9-(trifluoromethyl)-3H-1,4-benzodiazepin-5-yl]phenyl]propanamide IUPAC Name: N-[4-[2-amino-9-(trifluoromethyl)-3H-1,4-benzodiazepin-5-yl]phenyl]propanamide Traditional Name: N-[4-[2-amino-9-(trifluoromethyl)-3H-1,4-benzodiazepin-5-yl]phenyl]propionamide Formula: C19H17F3N4O MolecularWeight: 374.35969

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=NCC(=NC3=C2C=CC=C3C(F)(F)F)N

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NCC(=NC3=C2C=CC=C3C(F)(F)F)N

InChI

InChI=1S/C19H17F3N4O/c1-2-16(27)25-12-8-6-11(7-9-12)17-13-4-3-5-14(19(20,21)22)18(13)26-15(23)10-24-17/h3-9H,2,10H2,1H3,(H2,23,26)(H,25,27)