N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)CC(=O)N

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)CC(=O)N

InChI

InChI=1S/C17H17N5O3S/c1-9(2)22-16(25)12-6-4-3-5-11(12)14(21-22)15(24)20-17-19-10(8-26-17)7-13(18)23/h3-6,8-9H,7H2,1-2H3,(H2,18,23)(H,19,20,24)