N-(5-acetamido-2-methoxy-phenyl)-4-(6-acetamidopyridazin-3-yl)sulfanyl-butanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-4-(6-acetamidopyridazin-3-yl)sulfanyl-butanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-4-(6-acetamidopyridazin-3-yl)sulfanyl-butanamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-4-[(6-acetamido-3-pyridazinyl)thio]butanamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-4-(6-acetamidopyridazin-3-yl)sulfanylbutanamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-4-[(6-acetamidopyridazin-3-yl)thio]butyramide Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CCCSC2=NN=C(C=C2)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CCCSC2=NN=C(C=C2)NC(=O)C

InChI

InChI=1S/C19H23N5O4S/c1-12(25)20-14-6-7-16(28-3)15(11-14)22-18(27)5-4-10-29-19-9-8-17(23-24-19)21-13(2)26/h6-9,11H,4-5,10H2,1-3H3,(H,20,25)(H,22,27)(H,21,23,26)