2-[[(2S)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoyl]amino]thiophene-3-carboxamide

Systemtic Name: 2-[[(2S)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoyl]amino]thiophene-3-carboxamide Openeye Name: 2-[[(2S)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanylpropanoyl]amino]thiophene-3-carboxamide CAS Name: 2-[[(2S)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[(2S)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylpropanoyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[(2S)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]propanoyl]amino]thiophene-3-carboxamide Formula: C19H18N4O3S2 MolecularWeight: 414.50122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CS1)C(=O)N)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C19H18N4O3S2/c1-10(16(25)22-17-13(15(20)24)8-9-27-17)28-19-21-14-5-3-2-4-12(14)18(26)23(19)11-6-7-11/h2-5,8-11H,6-7H2,1H3,(H2,20,24)(H,22,25)/t10-/m0/s1