N-(4-oxidanylidene-1H-quinazolin-6-yl)-3-phenyl-pyrrolidine-1-carbothioamide

Systemtic Name: N-(4-oxidanylidene-1H-quinazolin-6-yl)-3-phenyl-pyrrolidine-1-carbothioamide Openeye Name: N-(4-oxo-1H-quinazolin-6-yl)-3-phenyl-pyrrolidine-1-carbothioamide CAS Name: N-(4-oxo-1H-quinazolin-6-yl)-3-phenyl-1-pyrrolidinecarbothioamide IUPAC Name: N-(4-oxo-1H-quinazolin-6-yl)-3-phenylpyrrolidine-1-carbothioamide Traditional Name: N-(4-keto-1H-quinazolin-6-yl)-3-phenyl-pyrrolidine-1-carbothioamide Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C2=CC=CC=C2)C(=S)NC3=CC4=C(C=C3)NC=NC4=O

Isomeric SMILES

C1CN(CC1C2=CC=CC=C2)C(=S)NC3=CC4=C(C=C3)NC=NC4=O

InChI

InChI=1S/C19H18N4OS/c24-18-16-10-15(6-7-17(16)20-12-21-18)22-19(25)23-9-8-14(11-23)13-4-2-1-3-5-13/h1-7,10,12,14H,8-9,11H2,(H,22,25)(H,20,21,24)