2-[3-(5-carbamimidoyl-6-chloranyl-1H-indol-2-yl)-4-oxidanyl-5-phenyl-phenyl]-N-(3-methoxypropyl)ethanamide

Systemtic Name: 2-[3-(5-carbamimidoyl-6-chloranyl-1H-indol-2-yl)-4-oxidanyl-5-phenyl-phenyl]-N-(3-methoxypropyl)ethanamide Openeye Name: 2-[3-(5-carbamimidoyl-6-chloro-1H-indol-2-yl)-4-hydroxy-5-phenyl-phenyl]-N-(3-methoxypropyl)acetamide CAS Name: 2-[3-(5-carbamimidoyl-6-chloro-1H-indol-2-yl)-4-hydroxy-5-phenylphenyl]-N-(3-methoxypropyl)acetamide IUPAC Name: 2-[3-(5-carbamimidoyl-6-chloro-1H-indol-2-yl)-4-hydroxy-5-phenylphenyl]-N-(3-methoxypropyl)acetamide Traditional Name: 2-[3-(5-amidino-6-chloro-1H-indol-2-yl)-4-hydroxy-5-phenyl-phenyl]-N-(3-methoxypropyl)acetamide Formula: C27H27ClN4O3 MolecularWeight: 490.98128

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CC1=CC(=C(C(=C1)C2=CC=CC=C2)O)C3=CC4=CC(=C(C=C4N3)Cl)C(=N)N

Isomeric SMILES

COCCCNC(=O)CC1=CC(=C(C(=C1)C2=CC=CC=C2)O)C3=CC4=CC(=C(C=C4N3)Cl)C(=N)N

InChI

InChI=1S/C27H27ClN4O3/c1-35-9-5-8-31-25(33)12-16-10-19(17-6-3-2-4-7-17)26(34)21(11-16)24-14-18-13-20(27(29)30)22(28)15-23(18)32-24/h2-4,6-7,10-11,13-15,32,34H,5,8-9,12H2,1H3,(H3,29,30)(H,31,33)