4-[di(propan-2-yl)amino]but-2-ynyl 7-oxidanylidene-8-phenyl-thieno[2,3-a]quinolizine-10-carboxylate

Systemtic Name: 4-[di(propan-2-yl)amino]but-2-ynyl 7-oxidanylidene-8-phenyl-thieno[2,3-a]quinolizine-10-carboxylate Openeye Name: 4-(diisopropylamino)but-2-ynyl 7-oxo-8-phenyl-thieno[2,3-a]quinolizine-10-carboxylate CAS Name: 7-oxo-8-phenyl-10-thieno[2,3-a]quinolizinecarboxylic acid 4-[di(propan-2-yl)amino]but-2-ynyl ester IUPAC Name: 4-[di(propan-2-yl)amino]but-2-ynyl 7-oxo-8-phenylthieno[2,3-a]quinolizine-10-carboxylate Traditional Name: 7-keto-8-phenyl-thieno[2,3-a]quinolizine-10-carboxylic acid 4-(diisopropylamino)but-2-ynyl ester Formula: C28H28N2O3S MolecularWeight: 472.59852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC#CCOC(=O)C1=C2C3=C(C=CN2C(=O)C(=C1)C4=CC=CC=C4)C=CS3)C(C)C

Isomeric SMILES

CC(C)N(CC#CCOC(=O)C1=C2C3=C(C=CN2C(=O)C(=C1)C4=CC=CC=C4)C=CS3)C(C)C

InChI

InChI=1S/C28H28N2O3S/c1-19(2)29(20(3)4)14-8-9-16-33-28(32)24-18-23(21-10-6-5-7-11-21)27(31)30-15-12-22-13-17-34-26(22)25(24)30/h5-7,10-13,15,17-20H,14,16H2,1-4H3