N-[(3,4-dichlorophenyl)methyl]-4-oxidanylidene-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-4-oxidanylidene-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(3,4-dichlorophenyl)methyl]-4-oxo-3-propyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(3,4-dichlorophenyl)methyl]-4-oxo-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-4-oxo-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3,4-dichlorobenzyl)-4-keto-3-propyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H17Cl2N3O2S MolecularWeight: 422.32818

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3)Cl)Cl)NC1=S

Isomeric SMILES

CCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3)Cl)Cl)NC1=S

InChI

InChI=1S/C19H17Cl2N3O2S/c1-2-7-24-18(26)13-5-4-12(9-16(13)23-19(24)27)17(25)22-10-11-3-6-14(20)15(21)8-11/h3-6,8-9H,2,7,10H2,1H3,(H,22,25)(H,23,27)