N,N-diethyl-4-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-butanamide

Systemtic Name: N,N-diethyl-4-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-butanamide Openeye Name: N,N-diethyl-4-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-butanamide CAS Name: N,N-diethyl-4-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]butanamide IUPAC Name: N,N-diethyl-4-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylbutanamide Traditional Name: N,N-diethyl-4-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]butyramide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCCSC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1C

Isomeric SMILES

CCN(CC)C(=O)CCCSC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1C

InChI

InChI=1S/C21H25N3O2S/c1-4-24(5-2)19(25)11-8-12-27-21-22-18-14-16-10-7-6-9-15(16)13-17(18)20(26)23(21)3/h6-7,9-10,13-14H,4-5,8,11-12H2,1-3H3