6-azanyl-5-[2-chloranylprop-2-enyl(3-oxidanylpropyl)amino]-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-chloranylprop-2-enyl(3-oxidanylpropyl)amino]-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 6-amino-1-benzyl-5-[2-chloroallyl(3-hydroxypropyl)amino]pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-chloroprop-2-enyl(3-hydroxypropyl)amino]-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-5-[2-chloroprop-2-enyl(3-hydroxypropyl)amino]pyrimidine-2,4-dione Traditional Name: 6-amino-1-benzyl-5-[2-chloroallyl(3-hydroxypropyl)amino]pyrimidine-2,4-quinone Formula: C17H21ClN4O3 MolecularWeight: 364.82664

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN(CCCO)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)Cl

Isomeric SMILES

C=C(CN(CCCO)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)Cl

InChI

InChI=1S/C17H21ClN4O3/c1-12(18)10-21(8-5-9-23)14-15(19)22(17(25)20-16(14)24)11-13-6-3-2-4-7-13/h2-4,6-7,23H,1,5,8-11,19H2,(H,20,24,25)