N-(3-imidazol-1-ylpropyl)-3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-3-isobutyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-3-isobutyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NCCCN3C=CN=C3)NC1=S

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NCCCN3C=CN=C3)NC1=S

InChI

InChI=1S/C19H23N5O2S/c1-13(2)11-24-18(26)15-5-4-14(10-16(15)22-19(24)27)17(25)21-6-3-8-23-9-7-20-12-23/h4-5,7,9-10,12-13H,3,6,8,11H2,1-2H3,(H,21,25)(H,22,27)