4-(1,3-dithian-2-yl)-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide

Systemtic Name: 4-(1,3-dithian-2-yl)-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide Openeye Name: 4-(1,3-dithian-2-yl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide CAS Name: 4-(1,3-dithian-2-yl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide IUPAC Name: 4-(1,3-dithian-2-yl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide Traditional Name: 4-(1,3-dithian-2-yl)-N-ethyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]benzamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)C4SCCCS4

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)C4SCCCS4

InChI

InChI=1S/C22H23N3O2S2/c1-2-25(14-19-23-18-7-4-3-6-17(18)20(26)24-19)21(27)15-8-10-16(11-9-15)22-28-12-5-13-29-22/h3-4,6-11,22H,2,5,12-14H2,1H3,(H,23,24,26)