2-(3-ethyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-N-[(2S)-heptan-2-yl]ethanamide

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-N-[(2S)-heptan-2-yl]ethanamide Openeye Name: 2-(3-ethyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-N-[(1S)-1-methylhexyl]acetamide CAS Name: 2-[(3-ethyl-4-oxo-2-benzo[g]quinazolinyl)thio]-N-[(2S)-heptan-2-yl]acetamide IUPAC Name: 2-(3-ethyl-4-oxobenzo[g]quinazolin-2-yl)sulfanyl-N-[(2S)-heptan-2-yl]acetamide Traditional Name: 2-[(3-ethyl-4-keto-benzo[g]quinazolin-2-yl)thio]-N-[(1S)-1-methylhexyl]acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CSC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1CC

Isomeric SMILES

CCCCC[C@H](C)NC(=O)CSC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1CC

InChI

InChI=1S/C23H29N3O2S/c1-4-6-7-10-16(3)24-21(27)15-29-23-25-20-14-18-12-9-8-11-17(18)13-19(20)22(28)26(23)5-2/h8-9,11-14,16H,4-7,10,15H2,1-3H3,(H,24,27)/t16-/m0/s1