2-(4-chlorophenyl)sulfanyl-N-(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)propanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)propanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)propanamide CAS Name: 2-[(4-chlorophenyl)thio]-N-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)propanamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)propanamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-(9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)propionamide Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)N=C3CCCN3C2=O)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)N=C3CCCN3C2=O)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN3O2S/c1-12(27-15-7-4-13(21)5-8-15)19(25)22-14-6-9-17-16(11-14)20(26)24-10-2-3-18(24)23-17/h4-9,11-12H,2-3,10H2,1H3,(H,22,25)