2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(4,7,7-trimethyl-5-oxidanylidene-6,8-dihydroquinazolin-2-yl)ethanamide

Systemtic Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(4,7,7-trimethyl-5-oxidanylidene-6,8-dihydroquinazolin-2-yl)ethanamide Openeye Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)acetamide CAS Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-N-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)acetamide IUPAC Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)acetamide Traditional Name: N-(5-keto-4,7,7-trimethyl-6,8-dihydroquinazolin-2-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]acetamide Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)OC

Isomeric SMILES

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)NC(=O)CSC3=NC4=C(N3)C=C(C=C4)OC

InChI

InChI=1S/C21H23N5O3S/c1-11-18-15(8-21(2,3)9-16(18)27)23-19(22-11)26-17(28)10-30-20-24-13-6-5-12(29-4)7-14(13)25-20/h5-7H,8-10H2,1-4H3,(H,24,25)(H,22,23,26,28)