N-[4-[(7-chloranyl-2,3,4,5-tetrahydro-1-benzazepin-1-yl)carbonyl]-2-methoxy-phenyl]-2-[3-(1,2,4-triazol-1-yl)propoxy]benzamide

Systemtic Name: N-[4-[(7-chloranyl-2,3,4,5-tetrahydro-1-benzazepin-1-yl)carbonyl]-2-methoxy-phenyl]-2-[3-(1,2,4-triazol-1-yl)propoxy]benzamide Openeye Name: N-[4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxy-phenyl]-2-[3-(1,2,4-triazol-1-yl)propoxy]benzamide CAS Name: N-[4-[(7-chloro-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-oxomethyl]-2-methoxyphenyl]-2-[3-(1,2,4-triazol-1-yl)propoxy]benzamide IUPAC Name: N-[4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxyphenyl]-2-[3-(1,2,4-triazol-1-yl)propoxy]benzamide Traditional Name: N-[4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxy-phenyl]-2-[3-(1,2,4-triazol-1-yl)propoxy]benzamide Formula: C30H30ClN5O4 MolecularWeight: 560.0433

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N2CCCCC3=C2C=CC(=C3)Cl)NC(=O)C4=CC=CC=C4OCCCN5C=NC=N5

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N2CCCCC3=C2C=CC(=C3)Cl)NC(=O)C4=CC=CC=C4OCCCN5C=NC=N5

InChI

InChI=1S/C30H30ClN5O4/c1-39-28-18-22(30(38)36-15-5-4-7-21-17-23(31)11-13-26(21)36)10-12-25(28)34-29(37)24-8-2-3-9-27(24)40-16-6-14-35-20-32-19-33-35/h2-3,8-13,17-20H,4-7,14-16H2,1H3,(H,34,37)