N-(cyclopropylcarbamoyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide

Systemtic Name: N-(cyclopropylcarbamoyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide Openeye Name: N-(cyclopropylcarbamoyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propanamide CAS Name: N-[(cyclopropylamino)-oxomethyl]-2-[(4-phenyl-1-phthalazinyl)thio]propanamide IUPAC Name: N-(cyclopropylcarbamoyl)-2-(4-phenylphthalazin-1-yl)sulfanylpropanamide Traditional Name: N-(cyclopropylcarbamoyl)-2-[(4-phenylphthalazin-1-yl)thio]propionamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC(=O)NC1CC1)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S/c1-13(19(26)23-21(27)22-15-11-12-15)28-20-17-10-6-5-9-16(17)18(24-25-20)14-7-3-2-4-8-14/h2-10,13,15H,11-12H2,1H3,(H2,22,23,26,27)