ethyl 2-[[4-(dimethylamino)pyridin-2-yl]methylsulfanyl]-1H-indole-5-carboxylate

Systemtic Name: ethyl 2-[[4-(dimethylamino)pyridin-2-yl]methylsulfanyl]-1H-indole-5-carboxylate Openeye Name: ethyl 2-[[4-(dimethylamino)-2-pyridyl]methylsulfanyl]-1H-indole-5-carboxylate CAS Name: 2-[[4-(dimethylamino)-2-pyridinyl]methylthio]-1H-indole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(dimethylamino)pyridin-2-yl]methylsulfanyl]-1H-indole-5-carboxylate Traditional Name: 2-[[4-(dimethylamino)-2-pyridyl]methylthio]-1H-indole-5-carboxylic acid ethyl ester Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC(=C2)SCC3=NC=CC(=C3)N(C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)NC(=C2)SCC3=NC=CC(=C3)N(C)C

InChI

InChI=1S/C19H21N3O2S/c1-4-24-19(23)13-5-6-17-14(9-13)10-18(21-17)25-12-15-11-16(22(2)3)7-8-20-15/h5-11,21H,4,12H2,1-3H3