2-chloranyl-N-[4-[[7-chloranyl-5-[2-[(5-methylpyrazin-2-yl)methylamino]-2-oxidanylidene-ethyl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methoxy-phenyl]benzamide

Systemtic Name: 2-chloranyl-N-[4-[[7-chloranyl-5-[2-[(5-methylpyrazin-2-yl)methylamino]-2-oxidanylidene-ethyl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methoxy-phenyl]benzamide Openeye Name: 2-chloro-N-[4-[7-chloro-5-[2-[(5-methylpyrazin-2-yl)methylamino]-2-oxo-ethyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxy-phenyl]benzamide CAS Name: 2-chloro-N-[4-[[7-chloro-5-[2-[(5-methyl-2-pyrazinyl)methylamino]-2-oxoethyl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-oxomethyl]-3-methoxyphenyl]benzamide IUPAC Name: 2-chloro-N-[4-[7-chloro-5-[2-[(5-methylpyrazin-2-yl)methylamino]-2-oxoethyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxyphenyl]benzamide Traditional Name: 2-chloro-N-[4-[7-chloro-5-[2-keto-2-[(5-methylpyrazin-2-yl)methylamino]ethyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxy-phenyl]benzamide Formula: C33H31Cl2N5O4 MolecularWeight: 632.53634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)CNC(=O)CC2CCCN(C3=C2C=C(C=C3)Cl)C(=O)C4=C(C=C(C=C4)NC(=O)C5=CC=CC=C5Cl)OC

Isomeric SMILES

CC1=CN=C(C=N1)CNC(=O)CC2CCCN(C3=C2C=C(C=C3)Cl)C(=O)C4=C(C=C(C=C4)NC(=O)C5=CC=CC=C5Cl)OC

InChI

InChI=1S/C33H31Cl2N5O4/c1-20-17-37-24(18-36-20)19-38-31(41)14-21-6-5-13-40(29-12-9-22(34)15-27(21)29)33(43)26-11-10-23(16-30(26)44-2)39-32(42)25-7-3-4-8-28(25)35/h3-4,7-12,15-18,21H,5-6,13-14,19H2,1-2H3,(H,38,41)(H,39,42)