7-[3-(aminomethyl)piperidin-1-yl]-3-azanyl-8-chloranyl-1-cyclopropyl-6-fluoranyl-quinazoline-2,4-dione

Systemtic Name: 7-[3-(aminomethyl)piperidin-1-yl]-3-azanyl-8-chloranyl-1-cyclopropyl-6-fluoranyl-quinazoline-2,4-dione Openeye Name: 3-amino-7-[3-(aminomethyl)-1-piperidyl]-8-chloro-1-cyclopropyl-6-fluoro-quinazoline-2,4-dione CAS Name: 3-amino-7-[3-(aminomethyl)-1-piperidinyl]-8-chloro-1-cyclopropyl-6-fluoroquinazoline-2,4-dione IUPAC Name: 3-amino-7-[3-(aminomethyl)piperidin-1-yl]-8-chloro-1-cyclopropyl-6-fluoroquinazoline-2,4-dione Traditional Name: 3-amino-7-[3-(aminomethyl)piperidino]-8-chloro-1-cyclopropyl-6-fluoro-quinazoline-2,4-quinone Formula: C17H21ClFN5O2 MolecularWeight: 381.832343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C3C(=C2Cl)N(C(=O)N(C3=O)N)C4CC4)F)CN

Isomeric SMILES

C1CC(CN(C1)C2=C(C=C3C(=C2Cl)N(C(=O)N(C3=O)N)C4CC4)F)CN

InChI

InChI=1S/C17H21ClFN5O2/c18-13-14-11(16(25)24(21)17(26)23(14)10-3-4-10)6-12(19)15(13)22-5-1-2-9(7-20)8-22/h6,9-10H,1-5,7-8,20-21H2