N-[(2S)-butan-2-yl]-3-(2-methoxyethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-3-(2-methoxyethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2-methoxyethyl)-N-[(1S)-1-methylpropyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(2S)-butan-2-yl]-3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(2S)-butan-2-yl]-3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-(2-methoxyethyl)-N-[(1S)-1-methylpropyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCOC

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCOC

InChI

InChI=1S/C16H21N3O3S/c1-4-10(2)17-14(20)11-5-6-12-13(9-11)18-16(23)19(15(12)21)7-8-22-3/h5-6,9-10H,4,7-8H2,1-3H3,(H,17,20)(H,18,23)/t10-/m0/s1