N-[2-[(3,4-dichlorophenyl)amino]-4-(methylamino)pyrimidin-5-yl]butane-1-sulfonamide

Systemtic Name: N-[2-[(3,4-dichlorophenyl)amino]-4-(methylamino)pyrimidin-5-yl]butane-1-sulfonamide Openeye Name: N-[2-(3,4-dichloroanilino)-4-(methylamino)pyrimidin-5-yl]butane-1-sulfonamide CAS Name: N-[2-(3,4-dichloroanilino)-4-(methylamino)-5-pyrimidinyl]-1-butanesulfonamide IUPAC Name: N-[2-(3,4-dichloroanilino)-4-(methylamino)pyrimidin-5-yl]butane-1-sulfonamide Traditional Name: N-[2-(3,4-dichloroanilino)-4-(methylamino)pyrimidin-5-yl]butane-1-sulfonamide Formula: C15H19Cl2N5O2S MolecularWeight: 404.31466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CN=C(N=C1NC)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCS(=O)(=O)NC1=CN=C(N=C1NC)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C15H19Cl2N5O2S/c1-3-4-7-25(23,24)22-13-9-19-15(21-14(13)18-2)20-10-5-6-11(16)12(17)8-10/h5-6,8-9,22H,3-4,7H2,1-2H3,(H2,18,19,20,21)