3-[3-(azepan-1-yl)propyl]-8-chloranyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[3-(azepan-1-yl)propyl]-8-chloranyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[3-(azepan-1-yl)propyl]-8-chloro-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[3-(1-azepanyl)propyl]-8-chloro-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[3-(azepan-1-yl)propyl]-8-chloro-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[3-(azepan-1-yl)propyl]-8-chloro-5H-pyrimid[5,4-b]indol-4-one Formula: C19H23ClN4O MolecularWeight: 358.86512

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)Cl

Isomeric SMILES

C1CCCN(CC1)CCCN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C19H23ClN4O/c20-14-6-7-16-15(12-14)17-18(22-16)19(25)24(13-21-17)11-5-10-23-8-3-1-2-4-9-23/h6-7,12-13,22H,1-5,8-11H2