N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NN=C(S3)CC(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NN=C(S3)CC(C)C

InChI

InChI=1S/C18H21N5O2S/c1-4-9-23-17(25)13-8-6-5-7-12(13)15(22-23)16(24)19-18-21-20-14(26-18)10-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,19,21,24)