1-(2-chloroethyl)-3-[4-[(3-chlorophenyl)amino]quinazolin-6-yl]urea

Systemtic Name: 1-(2-chloroethyl)-3-[4-[(3-chlorophenyl)amino]quinazolin-6-yl]urea Openeye Name: 1-[4-(3-chloroanilino)quinazolin-6-yl]-3-(2-chloroethyl)urea CAS Name: 1-[4-(3-chloroanilino)-6-quinazolinyl]-3-(2-chloroethyl)urea IUPAC Name: 1-[4-(3-chloroanilino)quinazolin-6-yl]-3-(2-chloroethyl)urea Traditional Name: 1-[4-(3-chloroanilino)quinazolin-6-yl]-3-(2-chloroethyl)urea Formula: C17H15Cl2N5O MolecularWeight: 376.2399

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=C2C=C(C=C3)NC(=O)NCCCl

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=NC3=C2C=C(C=C3)NC(=O)NCCCl

InChI

InChI=1S/C17H15Cl2N5O/c18-6-7-20-17(25)24-13-4-5-15-14(9-13)16(22-10-21-15)23-12-3-1-2-11(19)8-12/h1-5,8-10H,6-7H2,(H2,20,24,25)(H,21,22,23)