4-azanyl-8-(3-methylsulfonylphenyl)-N-propyl-cinnoline-3-carboxamide

Systemtic Name: 4-azanyl-8-(3-methylsulfonylphenyl)-N-propyl-cinnoline-3-carboxamide Openeye Name: 4-amino-8-(3-methylsulfonylphenyl)-N-propyl-cinnoline-3-carboxamide CAS Name: 4-amino-8-(3-methylsulfonylphenyl)-N-propyl-3-cinnolinecarboxamide IUPAC Name: 4-amino-8-(3-methylsulfonylphenyl)-N-propylcinnoline-3-carboxamide Traditional Name: 4-amino-8-(3-mesylphenyl)-N-propyl-cinnoline-3-carboxamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C2=C(C(=CC=C2)C3=CC(=CC=C3)S(=O)(=O)C)N=N1)N

Isomeric SMILES

CCCNC(=O)C1=C(C2=C(C(=CC=C2)C3=CC(=CC=C3)S(=O)(=O)C)N=N1)N

InChI

InChI=1S/C19H20N4O3S/c1-3-10-21-19(24)18-16(20)15-9-5-8-14(17(15)22-23-18)12-6-4-7-13(11-12)27(2,25)26/h4-9,11H,3,10H2,1-2H3,(H2,20,22)(H,21,24)