4-[(4-chlorophenyl)amino]-6-(3-oxidanylpyrrolidin-1-yl)-1,3,5-triazine-2-carbonitrile

Systemtic Name: 4-[(4-chlorophenyl)amino]-6-(3-oxidanylpyrrolidin-1-yl)-1,3,5-triazine-2-carbonitrile Openeye Name: 4-(4-chloroanilino)-6-(3-hydroxypyrrolidin-1-yl)-1,3,5-triazine-2-carbonitrile CAS Name: 4-(4-chloroanilino)-6-(3-hydroxy-1-pyrrolidinyl)-1,3,5-triazine-2-carbonitrile IUPAC Name: 4-(4-chloroanilino)-6-(3-hydroxypyrrolidin-1-yl)-1,3,5-triazine-2-carbonitrile Traditional Name: 4-(4-chloroanilino)-6-(3-hydroxypyrrolidino)-s-triazine-2-carbonitrile Formula: C14H13ClN6O MolecularWeight: 316.74562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)C2=NC(=NC(=N2)C#N)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC1O)C2=NC(=NC(=N2)C#N)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H13ClN6O/c15-9-1-3-10(4-2-9)17-13-18-12(7-16)19-14(20-13)21-6-5-11(22)8-21/h1-4,11,22H,5-6,8H2,(H,17,18,19,20)