N-(6-azanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-4-[bis(2-chloroethyl)amino]benzamide

Systemtic Name: N-(6-azanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-4-[bis(2-chloroethyl)amino]benzamide Openeye Name: N-(6-amino-4-oxo-1H-pyrimidin-5-yl)-4-[bis(2-chloroethyl)amino]benzamide CAS Name: N-(6-amino-4-oxo-1H-pyrimidin-5-yl)-4-[bis(2-chloroethyl)amino]benzamide IUPAC Name: N-(6-amino-4-oxo-1H-pyrimidin-5-yl)-4-[bis(2-chloroethyl)amino]benzamide Traditional Name: N-(6-amino-4-keto-1H-pyrimidin-5-yl)-4-[bis(2-chloroethyl)amino]benzamide Formula: C15H17Cl2N5O2 MolecularWeight: 370.23378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(NC=NC2=O)N)N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(NC=NC2=O)N)N(CCCl)CCCl

InChI

InChI=1S/C15H17Cl2N5O2/c16-5-7-22(8-6-17)11-3-1-10(2-4-11)14(23)21-12-13(18)19-9-20-15(12)24/h1-4,9H,5-8H2,(H,21,23)(H3,18,19,20,24)