4-[(3-cyanophenyl)amino]-8-methyl-6-methylsulfonyl-cinnoline-3-carboxamide

Systemtic Name: 4-[(3-cyanophenyl)amino]-8-methyl-6-methylsulfonyl-cinnoline-3-carboxamide Openeye Name: 4-(3-cyanoanilino)-8-methyl-6-methylsulfonyl-cinnoline-3-carboxamide CAS Name: 4-(3-cyanoanilino)-8-methyl-6-methylsulfonyl-3-cinnolinecarboxamide IUPAC Name: 4-(3-cyanoanilino)-8-methyl-6-methylsulfonylcinnoline-3-carboxamide Traditional Name: 4-(3-cyanoanilino)-6-mesyl-8-methyl-cinnoline-3-carboxamide Formula: C18H15N5O3S MolecularWeight: 381.4084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)C)C(=C(N=N2)C(=O)N)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)C)C(=C(N=N2)C(=O)N)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H15N5O3S/c1-10-6-13(27(2,25)26)8-14-15(10)22-23-17(18(20)24)16(14)21-12-5-3-4-11(7-12)9-19/h3-8H,1-2H3,(H2,20,24)(H,21,22)