N-(2-methylquinolin-6-yl)-N-methylsulfonyl-1-propan-2-yl-benzotriazole-5-carboxamide

Systemtic Name: N-(2-methylquinolin-6-yl)-N-methylsulfonyl-1-propan-2-yl-benzotriazole-5-carboxamide Openeye Name: 1-isopropyl-N-(2-methyl-6-quinolyl)-N-methylsulfonyl-benzotriazole-5-carboxamide CAS Name: N-(2-methyl-6-quinolinyl)-N-methylsulfonyl-1-propan-2-yl-5-benzotriazolecarboxamide IUPAC Name: N-(2-methylquinolin-6-yl)-N-methylsulfonyl-1-propan-2-ylbenzotriazole-5-carboxamide Traditional Name: 1-isopropyl-N-mesyl-N-(2-methyl-6-quinolyl)benzotriazole-5-carboxamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)N(C(=O)C3=CC4=C(C=C3)N(N=N4)C(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)N(C(=O)C3=CC4=C(C=C3)N(N=N4)C(C)C)S(=O)(=O)C

InChI

InChI=1S/C21H21N5O3S/c1-13(2)25-20-10-7-16(12-19(20)23-24-25)21(27)26(30(4,28)29)17-8-9-18-15(11-17)6-5-14(3)22-18/h5-13H,1-4H3