2-[[ethyl-[(3-methyl-2-sulfanylidene-benzimidazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[ethyl-[(3-methyl-2-sulfanylidene-benzimidazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[(3-methyl-2-thioxo-benzimidazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[(3-methyl-2-sulfanylidene-1-benzimidazolyl)methyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-[(3-methyl-2-thioxo-benzimidazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CN3C4=CC=CC=C4N(C3=S)C

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CN3C4=CC=CC=C4N(C3=S)C

InChI

InChI=1S/C20H21N5OS/c1-3-24(12-18-21-15-9-5-4-8-14(15)19(26)22-18)13-25-17-11-7-6-10-16(17)23(2)20(25)27/h4-11H,3,12-13H2,1-2H3,(H,21,22,26)