N-(3-aminocarbonylthiophen-2-yl)-3-butyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(3-aminocarbonylthiophen-2-yl)-3-butyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-(3-carbamoyl-2-thienyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-(3-carbamoyl-2-thiophenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-(3-carbamoylthiophen-2-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-(3-carbamoyl-2-thienyl)-4-keto-phthalazine-1-carboxamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C18H18N4O3S/c1-2-3-9-22-18(25)12-7-5-4-6-11(12)14(21-22)16(24)20-17-13(15(19)23)8-10-26-17/h4-8,10H,2-3,9H2,1H3,(H2,19,23)(H,20,24)