2-chloranyl-N-[4-[[7-fluoranyl-5-[2-[methyl(prop-2-enyl)amino]ethyl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methyl-phenyl]benzamide

Systemtic Name: 2-chloranyl-N-[4-[[7-fluoranyl-5-[2-[methyl(prop-2-enyl)amino]ethyl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methyl-phenyl]benzamide Openeye Name: N-[4-[5-[2-[allyl(methyl)amino]ethyl]-7-fluoro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methyl-phenyl]-2-chloro-benzamide CAS Name: 2-chloro-N-[4-[[7-fluoro-5-[2-[methyl(prop-2-enyl)amino]ethyl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-oxomethyl]-3-methylphenyl]benzamide IUPAC Name: 2-chloro-N-[4-[7-fluoro-5-[2-[methyl(prop-2-enyl)amino]ethyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methylphenyl]benzamide Traditional Name: N-[4-[5-[2-[allyl(methyl)amino]ethyl]-7-fluoro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methyl-phenyl]-2-chloro-benzamide Formula: C31H33ClFN3O2 MolecularWeight: 534.064023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2Cl)C(=O)N3CCCC(C4=C3C=CC(=C4)F)CCN(C)CC=C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2Cl)C(=O)N3CCCC(C4=C3C=CC(=C4)F)CCN(C)CC=C

InChI

InChI=1S/C31H33ClFN3O2/c1-4-16-35(3)18-15-22-8-7-17-36(29-14-11-23(33)20-27(22)29)31(38)25-13-12-24(19-21(25)2)34-30(37)26-9-5-6-10-28(26)32/h4-6,9-14,19-20,22H,1,7-8,15-18H2,2-3H3,(H,34,37)