ethyl 5-methyl-3-[2-[[methylsulfanyl-(naphthalen-1-ylamino)methylidene]amino]ethyl]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-methyl-3-[2-[[methylsulfanyl-(naphthalen-1-ylamino)methylidene]amino]ethyl]-1H-indole-2-carboxylate Openeye Name: ethyl 5-methyl-3-[2-[[methylsulfanyl-(1-naphthylamino)methylene]amino]ethyl]-1H-indole-2-carboxylate CAS Name: 5-methyl-3-[2-[[(methylthio)-(1-naphthalenylamino)methylidene]amino]ethyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-[2-[[methylsulfanyl-(naphthalen-1-ylamino)methylidene]amino]ethyl]-1H-indole-2-carboxylate Traditional Name: 5-methyl-3-[2-[[(methylthio)-(1-naphthylamino)methylene]amino]ethyl]-1H-indole-2-carboxylic acid ethyl ester Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C)CCN=C(NC3=CC=CC4=CC=CC=C43)SC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C)CCN=C(NC3=CC=CC4=CC=CC=C43)SC

InChI

InChI=1S/C26H27N3O2S/c1-4-31-25(30)24-20(21-16-17(2)12-13-23(21)28-24)14-15-27-26(32-3)29-22-11-7-9-18-8-5-6-10-19(18)22/h5-13,16,28H,4,14-15H2,1-3H3,(H,27,29)