2-azanyl-6-methyl-5-(phenylsulfonyl)-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2-azanyl-6-methyl-5-(phenylsulfonyl)-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2-amino-5-(benzenesulfonyl)-6-methyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2-amino-5-(benzenesulfonyl)-6-methyl-4-(3-pyridinyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2-amino-5-(benzenesulfonyl)-6-methyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2-amino-5-besyl-6-methyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)N)C(=O)O)C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(C(=C(N1)N)C(=O)O)C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O4S/c1-11-16(26(24,25)13-7-3-2-4-8-13)14(12-6-5-9-20-10-12)15(18(22)23)17(19)21-11/h2-10,14,21H,19H2,1H3,(H,22,23)