3-ethyl-N-methyl-4-oxidanylidene-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-N-methyl-4-oxidanylidene-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-3-ethyl-N-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-N-methyl-4-oxo-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-3-ethyl-N-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-3-ethyl-4-keto-N-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=CN(N=C3)CC4=CC=CC=C4)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=CN(N=C3)CC4=CC=CC=C4)NC1=S

InChI

InChI=1S/C23H23N5O2S/c1-3-28-22(30)19-10-9-18(11-20(19)25-23(28)31)21(29)26(2)13-17-12-24-27(15-17)14-16-7-5-4-6-8-16/h4-12,15H,3,13-14H2,1-2H3,(H,25,31)