N-[(5-chloranylthiophen-2-yl)methyl]-3-methyl-4-oxidanylidene-N-prop-2-enyl-phthalazine-1-carboxamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-3-methyl-4-oxidanylidene-N-prop-2-enyl-phthalazine-1-carboxamide Openeye Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-3-methyl-4-oxo-N-prop-2-enyl-1-phthalazinecarboxamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-3-methyl-4-oxo-N-prop-2-enylphthalazine-1-carboxamide Traditional Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C18H16ClN3O2S MolecularWeight: 373.85654

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC=C)CC3=CC=C(S3)Cl

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC=C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C18H16ClN3O2S/c1-3-10-22(11-12-8-9-15(19)25-12)18(24)16-13-6-4-5-7-14(13)17(23)21(2)20-16/h3-9H,1,10-11H2,2H3