4-pyrrolidin-1-ylbut-2-ynyl phenothiazine-10-carboxylate

Systemtic Name: 4-pyrrolidin-1-ylbut-2-ynyl phenothiazine-10-carboxylate Openeye Name: 4-pyrrolidin-1-ylbut-2-ynyl phenothiazine-10-carboxylate CAS Name: 10-phenothiazinecarboxylic acid 4-(1-pyrrolidinyl)but-2-ynyl ester IUPAC Name: 4-pyrrolidin-1-ylbut-2-ynyl phenothiazine-10-carboxylate Traditional Name: phenothiazine-10-carboxylic acid 4-pyrrolidinobut-2-ynyl ester Formula: C21H20N2O2S MolecularWeight: 364.4607

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC#CCOC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

C1CCN(C1)CC#CCOC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C21H20N2O2S/c24-21(25-16-8-7-15-22-13-5-6-14-22)23-17-9-1-3-11-19(17)26-20-12-4-2-10-18(20)23/h1-4,9-12H,5-6,13-16H2