(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl) 2-propan-2-yl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl) 2-propan-2-yl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate Openeye Name: 1-(phenothiazine-10-carbonyl)propyl 2-isopropyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate CAS Name: 2-propan-2-yl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid [1-oxo-1-(10-phenothiazinyl)butan-2-yl] ester IUPAC Name: (1-oxo-1-phenothiazin-10-ylbutan-2-yl) 2-propan-2-yl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate Traditional Name: 2-isopropyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid 1-(phenothiazine-10-carbonyl)propyl ester Formula: C32H31N3O3S MolecularWeight: 537.67184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)OC(=O)C4=C5CN(CCC5=NC6=CC=CC=C64)C(C)C

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)OC(=O)C4=C5CN(CCC5=NC6=CC=CC=C64)C(C)C

InChI

InChI=1S/C32H31N3O3S/c1-4-27(31(36)35-25-13-7-9-15-28(25)39-29-16-10-8-14-26(29)35)38-32(37)30-21-11-5-6-12-23(21)33-24-17-18-34(20(2)3)19-22(24)30/h5-16,20,27H,4,17-19H2,1-3H3