3-[4-[(2S)-butan-2-yl]phenyl]-7-chloranyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-[4-[(2S)-butan-2-yl]phenyl]-7-chloranyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-chloro-3-[4-[(1S)-1-methylpropyl]phenyl]-2-thioxo-quinazolin-4-olate CAS Name: 3-[4-[(2S)-butan-2-yl]phenyl]-7-chloro-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-[4-[(2S)-butan-2-yl]phenyl]-7-chloro-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-chloro-3-[4-[(1S)-1-methylpropyl]phenyl]-2-thioxo-quinazolin-4-olate Formula: C18H16ClN2OS- MolecularWeight: 343.85044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=C3C=CC(=CC3=NC2=S)Cl)[O-]

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)N2C(=C3C=CC(=CC3=NC2=S)Cl)[O-]

InChI

InChI=1S/C18H17ClN2OS/c1-3-11(2)12-4-7-14(8-5-12)21-17(22)15-9-6-13(19)10-16(15)20-18(21)23/h4-11,22H,3H2,1-2H3/p-1/t11-/m0/s1