N,N-dimethyl-4-[(phenylmethyl)amino]-2-pyridin-3-yl-quinazoline-6-sulfonamide

Systemtic Name: N,N-dimethyl-4-[(phenylmethyl)amino]-2-pyridin-3-yl-quinazoline-6-sulfonamide Openeye Name: 4-(benzylamino)-N,N-dimethyl-2-(3-pyridyl)quinazoline-6-sulfonamide CAS Name: N,N-dimethyl-4-[(phenylmethyl)amino]-2-(3-pyridinyl)-6-quinazolinesulfonamide IUPAC Name: 4-(benzylamino)-N,N-dimethyl-2-pyridin-3-ylquinazoline-6-sulfonamide Traditional Name: 4-(benzylamino)-N,N-dimethyl-2-(3-pyridyl)quinazoline-6-sulfonamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(N=C2NCC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(N=C2NCC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C22H21N5O2S/c1-27(2)30(28,29)18-10-11-20-19(13-18)22(24-14-16-7-4-3-5-8-16)26-21(25-20)17-9-6-12-23-15-17/h3-13,15H,14H2,1-2H3,(H,24,25,26)