N,N-bis[(2R)-butan-2-yl]-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N,N-bis[(2R)-butan-2-yl]-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-N,N-bis[(1R)-1-methylpropyl]acetamide CAS Name: N,N-bis[(2R)-butan-2-yl]-2-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]acetamide IUPAC Name: N,N-bis[(2R)-butan-2-yl]-2-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]-N,N-bis[(1R)-1-methylpropyl]acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C(C)CC)C(=O)CSC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1C

Isomeric SMILES

CC[C@@H](C)N([C@H](C)CC)C(=O)CSC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1C

InChI

InChI=1S/C23H29N3O2S/c1-6-15(3)26(16(4)7-2)21(27)14-29-23-24-20-13-18-11-9-8-10-17(18)12-19(20)22(28)25(23)5/h8-13,15-16H,6-7,14H2,1-5H3/t15-,16-/m1/s1